N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]-2,2-diphenyl-ethanamide

Systemtic Name: N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]-2,2-diphenyl-ethanamide Openeye Name: N-[[3-methoxy-4-[2-(2-pyridyl)ethoxy]phenyl]methyl]-N-[(3S)-2-oxoazepan-3-yl]-2,2-diphenyl-acetamide CAS Name: N-[[3-methoxy-4-[2-(2-pyridinyl)ethoxy]phenyl]methyl]-N-[(3S)-2-oxo-3-azepanyl]-2,2-diphenylacetamide IUPAC Name: N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-N-[(3S)-2-oxoazepan-3-yl]-2,2-diphenylacetamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-N-[3-methoxy-4-[2-(2-pyridyl)ethoxy]benzyl]-2,2-diphenyl-acetamide Formula: C35H37N3O4 MolecularWeight: 563.68598

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN(C2CCCCNC2=O)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)OCCC5=CC=CC=N5

Isomeric SMILES

COC1=C(C=CC(=C1)CN([C@H]2CCCCNC2=O)C(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)OCCC5=CC=CC=N5

InChI

InChI=1S/C35H37N3O4/c1-41-32-24-26(18-19-31(32)42-23-20-29-16-8-10-21-36-29)25-38(30-17-9-11-22-37-34(30)39)35(40)33(27-12-4-2-5-13-27)28-14-6-3-7-15-28/h2-8,10,12-16,18-19,21,24,30,33H,9,11,17,20,22-23,25H2,1H3,(H,37,39)/t30-/m0/s1