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

Systemtic Name: N-[3-[[3-azanylpropyl-(3,4-dimethoxyphenyl)carbonyl-amino]methyl]-4-chloranyl-phenyl]pyridine-3-carboxamide Openeye Name: N-[3-[[3-aminopropyl-(3,4-dimethoxybenzoyl)amino]methyl]-4-chloro-phenyl]pyridine-3-carboxamide CAS Name: N-[3-[[3-aminopropyl-[(3,4-dimethoxyphenyl)-oxomethyl]amino]methyl]-4-chlorophenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[[3-aminopropyl-(3,4-dimethoxybenzoyl)amino]methyl]-4-chlorophenyl]pyridine-3-carboxamide Traditional Name: N-[3-[[3-aminopropyl(veratroyl)amino]methyl]-4-chloro-phenyl]nicotinamide Formula: C25H27ClN4O4 MolecularWeight: 482.95928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27ClN4O4/c1-33-22-9-6-17(14-23(22)34-2)25(32)30(12-4-10-27)16-19-13-20(7-8-21(19)26)29-24(31)18-5-3-11-28-15-18/h3,5-9,11,13-15H,4,10,12,16,27H2,1-2H3,(H,29,31)