V0M

2-[({2-[(2,6-dichlorophenyl)amino]phenyl}acetyl)amino]-2,3-dihydro-1H-indene-2-carboxylic acid

Created:	2020-06-10
Last modified:	2020-09-23

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1 entries where V0M is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	51
Chiral Atom Count	0
Bond Count	54
Aromatic Bond Count	18

2D diagram of V0M

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Chemical Component Summary
Name	2-[({2-[(2,6-dichlorophenyl)amino]phenyl}acetyl)amino]-2,3-dihydro-1H-indene-2-carboxylic acid
Systematic Name (OpenEye OEToolkits)	2-[2-[2-[[2,6-bis(chloranyl)phenyl]amino]phenyl]ethanoylamino]-1,3-dihydroindene-2-carboxylic acid
Formula	C₂₄ H₂₀ Cl₂ N₂ O₃
Molecular Weight	455.333
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	C4(NC(=O)Cc2c(Nc1c(cccc1Cl)Cl)cccc2)(Cc3ccccc3C4)C(=O)O
SMILES	CACTVS	3.385	OC(=O)C1(Cc2ccccc2C1)NC(=O)Cc3ccccc3Nc4c(Cl)cccc4Cl
SMILES	OpenEye OEToolkits	2.0.7	c1ccc2c(c1)CC(C2)(C(=O)O)NC(=O)Cc3ccccc3Nc4c(cccc4Cl)Cl
Canonical SMILES	CACTVS	3.385	OC(=O)C1(Cc2ccccc2C1)NC(=O)Cc3ccccc3Nc4c(Cl)cccc4Cl
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc2c(c1)CC(C2)(C(=O)O)NC(=O)Cc3ccccc3Nc4c(cccc4Cl)Cl
InChI	InChI	1.03	InChI=1S/C24H20Cl2N2O3/c25-18-9-5-10-19(26)22(18)27-20-11-4-3-6-15(20)12-21(29)28-24(23(30)31)13-16-7-1-2-8-17(16)14-24/h1-11,27H,12-14H2,(H,28,29)(H,30,31)
InChIKey	InChI	1.03	ZBVLZAHLDOOBNG-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	154585754

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