TW8

4-(3,4-dihydro-2~{H}-quinoxalin-1-ylsulfonyl)benzaldehyde

Created:	2021-01-14
Last modified:	2024-09-27

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1 entries where TW8 is covalently linked to polymer or other heterogen groups

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Chemical Details
Formal Charge	0
Atom Count	35
Chiral Atom Count	0
Bond Count	37
Aromatic Bond Count	12

2D diagram of TW8

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Chemical Component Summary
Name	4-(3,4-dihydro-2~{H}-quinoxalin-1-ylsulfonyl)benzaldehyde
Systematic Name (OpenEye OEToolkits)	4-(3,4-dihydro-2~{H}-quinoxalin-1-ylsulfonyl)benzaldehyde
Formula	C₁₅ H₁₄ N₂ O₃ S
Molecular Weight	302.348
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	O=Cc1ccc(cc1)[S](=O)(=O)N2CCNc3ccccc23
SMILES	OpenEye OEToolkits	2.0.7	c1ccc2c(c1)NCCN2S(=O)(=O)c3ccc(cc3)C=O
Canonical SMILES	CACTVS	3.385	O=Cc1ccc(cc1)[S](=O)(=O)N2CCNc3ccccc23
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc2c(c1)NCCN2S(=O)(=O)c3ccc(cc3)C=O
InChI	InChI	1.03	InChI=1S/C15H14N2O3S/c18-11-12-5-7-13(8-6-12)21(19,20)17-10-9-16-14-3-1-2-4-15(14)17/h1-8,11,16H,9-10H2
InChIKey	InChI	1.03	GOMXOBFYQBMFTF-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	156596345

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