N-[3-[[3-azanylpropyl-(3,4-dimethoxyphenyl)carbonyl-amino]methyl]phenyl]pyridine-4-carboxamide

Systemtic Name: N-[3-[[3-azanylpropyl-(3,4-dimethoxyphenyl)carbonyl-amino]methyl]phenyl]pyridine-4-carboxamide Openeye Name: N-[3-[[3-aminopropyl-(3,4-dimethoxybenzoyl)amino]methyl]phenyl]pyridine-4-carboxamide CAS Name: N-[3-[[3-aminopropyl-[(3,4-dimethoxyphenyl)-oxomethyl]amino]methyl]phenyl]-4-pyridinecarboxamide IUPAC Name: N-[3-[[3-aminopropyl-(3,4-dimethoxybenzoyl)amino]methyl]phenyl]pyridine-4-carboxamide Traditional Name: N-[3-[[3-aminopropyl(veratroyl)amino]methyl]phenyl]isonicotinamide Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)C3=CC=NC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)C3=CC=NC=C3)OC

InChI

InChI=1S/C25H28N4O4/c1-32-22-8-7-20(16-23(22)33-2)25(31)29(14-4-11-26)17-18-5-3-6-21(15-18)28-24(30)19-9-12-27-13-10-19/h3,5-10,12-13,15-16H,4,11,14,17,26H2,1-2H3,(H,28,30)