M8N
~{N}-[[[2-methyl-4-(3-methylbutyl)phenyl]amino]methyl]hydroxylamine
Created: | 2019-10-04 |
Last modified: | 2020-10-14 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 38 |
Chiral Atom Count | 0 |
Bond Count | 38 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | ~{N}-[[[2-methyl-4-(3-methylbutyl)phenyl]amino]methyl]hydroxylamine |
Systematic Name (OpenEye OEToolkits) | ~{N}-[[[2-methyl-4-(3-methylbutyl)phenyl]amino]methyl]hydroxylamine |
Formula | C13 H22 N2 O |
Molecular Weight | 222.327 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CC(C)CCc1ccc(NCNO)c(C)c1 |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(ccc1NCNO)CCC(C)C |
Canonical SMILES | CACTVS | 3.385 | CC(C)CCc1ccc(NCNO)c(C)c1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | Cc1cc(ccc1NCNO)CCC(C)C |
InChI | InChI | 1.03 | InChI=1S/C13H22N2O/c1-10(2)4-5-12-6-7-13(11(3)8-12)14-9-15-16/h6-8,10,14-16H,4-5,9H2,1-3H3 |
InChIKey | InChI | 1.03 | BNHIDDHQCYEQMT-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 155804456 |