N-[3-[[3-azanylpropyl(phenylcarbonyl)amino]methyl]-4-chloranyl-phenyl]-3-methoxy-benzamide

Systemtic Name: N-[3-[[3-azanylpropyl(phenylcarbonyl)amino]methyl]-4-chloranyl-phenyl]-3-methoxy-benzamide Openeye Name: N-[3-[[3-aminopropyl(benzoyl)amino]methyl]-4-chloro-phenyl]-3-methoxy-benzamide CAS Name: N-[3-[[3-aminopropyl(benzoyl)amino]methyl]-4-chlorophenyl]-3-methoxybenzamide IUPAC Name: N-[3-[[3-aminopropyl(benzoyl)amino]methyl]-4-chlorophenyl]-3-methoxybenzamide Traditional Name: N-[3-[[3-aminopropyl(benzoyl)amino]methyl]-4-chloro-phenyl]-3-methoxy-benzamide Formula: C25H26ClN3O3 MolecularWeight: 451.94524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)Cl)CN(CCCN)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC2=CC(=C(C=C2)Cl)CN(CCCN)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H26ClN3O3/c1-32-22-10-5-9-19(16-22)24(30)28-21-11-12-23(26)20(15-21)17-29(14-6-13-27)25(31)18-7-3-2-4-8-18/h2-5,7-12,15-16H,6,13-14,17,27H2,1H3,(H,28,30)