N-[(3S)-2-oxidanylideneazepan-3-yl]-2-phenoxy-N-[(4-pyridin-2-ylphenyl)methyl]ethanamide

Systemtic Name: N-[(3S)-2-oxidanylideneazepan-3-yl]-2-phenoxy-N-[(4-pyridin-2-ylphenyl)methyl]ethanamide Openeye Name: N-[(3S)-2-oxoazepan-3-yl]-2-phenoxy-N-[[4-(2-pyridyl)phenyl]methyl]acetamide CAS Name: N-[(3S)-2-oxo-3-azepanyl]-2-phenoxy-N-[[4-(2-pyridinyl)phenyl]methyl]acetamide IUPAC Name: N-[(3S)-2-oxoazepan-3-yl]-2-phenoxy-N-[(4-pyridin-2-ylphenyl)methyl]acetamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-2-phenoxy-N-[4-(2-pyridyl)benzyl]acetamide Formula: C26H27N3O3 MolecularWeight: 429.51088

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC=C(C=C2)C3=CC=CC=N3)C(=O)COC4=CC=CC=C4

Isomeric SMILES

C1CCNC(=O)[C@H](C1)N(CC2=CC=C(C=C2)C3=CC=CC=N3)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O3/c30-25(19-32-22-8-2-1-3-9-22)29(24-11-5-7-17-28-26(24)31)18-20-12-14-21(15-13-20)23-10-4-6-16-27-23/h1-4,6,8-10,12-16,24H,5,7,11,17-19H2,(H,28,31)/t24-/m0/s1