4-azanyl-N-[(3,4-dimethoxyphenyl)methyl]-3-nitro-benzamide

Systemtic Name: 4-azanyl-N-[(3,4-dimethoxyphenyl)methyl]-3-nitro-benzamide Openeye Name: 4-amino-N-[(3,4-dimethoxyphenyl)methyl]-3-nitro-benzamide CAS Name: 4-amino-N-[(3,4-dimethoxyphenyl)methyl]-3-nitrobenzamide IUPAC Name: 4-amino-N-[(3,4-dimethoxyphenyl)methyl]-3-nitrobenzamide Traditional Name: 4-amino-3-nitro-N-veratryl-benzamide Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])OC

InChI

InChI=1S/C16H17N3O5/c1-23-14-6-3-10(7-15(14)24-2)9-18-16(20)11-4-5-12(17)13(8-11)19(21)22/h3-8H,9,17H2,1-2H3,(H,18,20)