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4-(cyclopropylamino)-N-[(3,4-dimethoxyphenyl)methyl]-3-nitro-benzamide
4-(cyclopropylamino)-N-[(3,4-dimethoxyphenyl)methyl]-3-nitro-benzamide
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Descriptors Computed from Structure
Canonical SMILES:
COC1=C(C=C(C=C1)CNC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-])OC
Isomeric SMILES
COC1=C(C=C(C=C1)CNC(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-])OC
InChI
InChI=1S/C19H21N3O5/c1-26-17-8-3-12(9-18(17)27-2)11-20-19(23)13-4-7-15(21-14-5-6-14)16(10-13)22(24)25/h3-4,7-10,14,21H,5-6,11H2,1-2H3,(H,20,23)
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