4-[(4-nitrophenyl)amino]-N-[(3,4,5-trimethoxyphenyl)methyl]butanamide

Systemtic Name: 4-[(4-nitrophenyl)amino]-N-[(3,4,5-trimethoxyphenyl)methyl]butanamide Openeye Name: 4-(4-nitroanilino)-N-[(3,4,5-trimethoxyphenyl)methyl]butanamide CAS Name: 4-(4-nitroanilino)-N-[(3,4,5-trimethoxyphenyl)methyl]butanamide IUPAC Name: 4-(4-nitroanilino)-N-[(3,4,5-trimethoxyphenyl)methyl]butanamide Traditional Name: 4-(4-nitroanilino)-N-(3,4,5-trimethoxybenzyl)butyramide Formula: C20H25N3O6 MolecularWeight: 403.429

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)CCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O6/c1-27-17-11-14(12-18(28-2)20(17)29-3)13-22-19(24)5-4-10-21-15-6-8-16(9-7-15)23(25)26/h6-9,11-12,21H,4-5,10,13H2,1-3H3,(H,22,24)