N-(3-azanylpropyl)-N-[[3-(2-phenoxyethanoylamino)phenyl]methyl]benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[[3-(2-phenoxyethanoylamino)phenyl]methyl]benzamide Openeye Name: N-(3-aminopropyl)-N-[[3-[(2-phenoxyacetyl)amino]phenyl]methyl]benzamide CAS Name: N-(3-aminopropyl)-N-[[3-[(1-oxo-2-phenoxyethyl)amino]phenyl]methyl]benzamide IUPAC Name: N-(3-aminopropyl)-N-[[3-[(2-phenoxyacetyl)amino]phenyl]methyl]benzamide Traditional Name: N-(3-aminopropyl)-N-[3-[(2-phenoxyacetyl)amino]benzyl]benzamide Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N(CCCN)CC2=CC(=CC=C2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C25H27N3O3/c26-15-8-16-28(25(30)21-10-3-1-4-11-21)18-20-9-7-12-22(17-20)27-24(29)19-31-23-13-5-2-6-14-23/h1-7,9-14,17H,8,15-16,18-19,26H2,(H,27,29)