2,3-dimethoxy-N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide

Systemtic Name: 2,3-dimethoxy-N-[(3S)-2-oxidanylideneazepan-3-yl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide Openeye Name: 2,3-dimethoxy-N-[(3S)-2-oxoazepan-3-yl]-N-[[4-(2-pyridylmethoxy)phenyl]methyl]benzamide CAS Name: 2,3-dimethoxy-N-[(3S)-2-oxo-3-azepanyl]-N-[[4-(2-pyridinylmethoxy)phenyl]methyl]benzamide IUPAC Name: 2,3-dimethoxy-N-[(3S)-2-oxoazepan-3-yl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-2,3-dimethoxy-N-[4-(2-pyridylmethoxy)benzyl]benzamide Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C(=O)N(CC2=CC=C(C=C2)OCC3=CC=CC=N3)C4CCCCNC4=O

Isomeric SMILES

COC1=CC=CC(=C1OC)C(=O)N(CC2=CC=C(C=C2)OCC3=CC=CC=N3)[C@H]4CCCCNC4=O

InChI

InChI=1S/C28H31N3O5/c1-34-25-11-7-9-23(26(25)35-2)28(33)31(24-10-4-6-17-30-27(24)32)18-20-12-14-22(15-13-20)36-19-21-8-3-5-16-29-21/h3,5,7-9,11-16,24H,4,6,10,17-19H2,1-2H3,(H,30,32)/t24-/m0/s1