2-(3-carbamimidoylphenoxy)-N-[[4-(2-oxidanylidenepiperidin-1-yl)phenyl]methyl]-2-phenyl-ethanamide

Systemtic Name: 2-(3-carbamimidoylphenoxy)-N-[[4-(2-oxidanylidenepiperidin-1-yl)phenyl]methyl]-2-phenyl-ethanamide Openeye Name: 2-(3-carbamimidoylphenoxy)-N-[[4-(2-oxo-1-piperidyl)phenyl]methyl]-2-phenyl-acetamide CAS Name: 2-(3-carbamimidoylphenoxy)-N-[[4-(2-oxo-1-piperidinyl)phenyl]methyl]-2-phenylacetamide IUPAC Name: 2-(3-carbamimidoylphenoxy)-N-[[4-(2-oxopiperidin-1-yl)phenyl]methyl]-2-phenylacetamide Traditional Name: 2-(3-amidinophenoxy)-N-[4-(2-ketopiperidino)benzyl]-2-phenyl-acetamide Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2=CC=C(C=C2)CNC(=O)C(C3=CC=CC=C3)OC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

C1CCN(C(=O)C1)C2=CC=C(C=C2)CNC(=O)C(C3=CC=CC=C3)OC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C27H28N4O3/c28-26(29)21-9-6-10-23(17-21)34-25(20-7-2-1-3-8-20)27(33)30-18-19-12-14-22(15-13-19)31-16-5-4-11-24(31)32/h1-3,6-10,12-15,17,25H,4-5,11,16,18H2,(H3,28,29)(H,30,33)