N-[3-[[3-azanylpropyl-(4-methoxyphenyl)carbonyl-amino]methyl]phenyl]-4-nitro-benzamide

Systemtic Name: N-[3-[[3-azanylpropyl-(4-methoxyphenyl)carbonyl-amino]methyl]phenyl]-4-nitro-benzamide Openeye Name: N-[3-[[3-aminopropyl-(4-methoxybenzoyl)amino]methyl]phenyl]-4-nitro-benzamide CAS Name: N-[3-[[3-aminopropyl-[(4-methoxyphenyl)-oxomethyl]amino]methyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[3-[[3-aminopropyl-(4-methoxybenzoyl)amino]methyl]phenyl]-4-nitrobenzamide Traditional Name: N-[3-[[3-aminopropyl(p-anisoyl)amino]methyl]phenyl]-4-nitro-benzamide Formula: C25H26N4O5 MolecularWeight: 462.49774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H26N4O5/c1-34-23-12-8-20(9-13-23)25(31)28(15-3-14-26)17-18-4-2-5-21(16-18)27-24(30)19-6-10-22(11-7-19)29(32)33/h2,4-13,16H,3,14-15,17,26H2,1H3,(H,27,30)