3,5-dimethoxy-N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]benzamide

Systemtic Name: 3,5-dimethoxy-N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-N-[(3S)-2-oxidanylideneazepan-3-yl]benzamide Openeye Name: 3,5-dimethoxy-N-[[3-methoxy-4-[2-(2-pyridyl)ethoxy]phenyl]methyl]-N-[(3S)-2-oxoazepan-3-yl]benzamide CAS Name: 3,5-dimethoxy-N-[[3-methoxy-4-[2-(2-pyridinyl)ethoxy]phenyl]methyl]-N-[(3S)-2-oxo-3-azepanyl]benzamide IUPAC Name: 3,5-dimethoxy-N-[[3-methoxy-4-(2-pyridin-2-ylethoxy)phenyl]methyl]-N-[(3S)-2-oxoazepan-3-yl]benzamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-3,5-dimethoxy-N-[3-methoxy-4-[2-(2-pyridyl)ethoxy]benzyl]benzamide Formula: C30H35N3O6 MolecularWeight: 533.6154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N(CC2=CC(=C(C=C2)OCCC3=CC=CC=N3)OC)C4CCCCNC4=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N(CC2=CC(=C(C=C2)OCCC3=CC=CC=N3)OC)[C@H]4CCCCNC4=O)OC

InChI

InChI=1S/C30H35N3O6/c1-36-24-17-22(18-25(19-24)37-2)30(35)33(26-9-5-7-14-32-29(26)34)20-21-10-11-27(28(16-21)38-3)39-15-12-23-8-4-6-13-31-23/h4,6,8,10-11,13,16-19,26H,5,7,9,12,14-15,20H2,1-3H3,(H,32,34)/t26-/m0/s1