2-[4-(azepan-1-yl)-6,7-dimethoxy-2-oxidanyl-naphthalen-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-(azepan-1-yl)-6,7-dimethoxy-2-oxidanyl-naphthalen-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-(azepan-1-yl)-2-hydroxy-6,7-dimethoxy-1-naphthyl]-N-phenyl-acetamide CAS Name: 2-[4-(1-azepanyl)-2-hydroxy-6,7-dimethoxy-1-naphthalenyl]-N-phenylacetamide IUPAC Name: 2-[4-(azepan-1-yl)-2-hydroxy-6,7-dimethoxynaphthalen-1-yl]-N-phenylacetamide Traditional Name: 2-[4-(azepan-1-yl)-2-hydroxy-6,7-dimethoxy-1-naphthyl]-N-phenyl-acetamide Formula: C26H30N2O4 MolecularWeight: 434.5274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=CC(=C2CC(=O)NC3=CC=CC=C3)O)N4CCCCCC4)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=CC(=C2CC(=O)NC3=CC=CC=C3)O)N4CCCCCC4)OC

InChI

InChI=1S/C26H30N2O4/c1-31-24-14-19-20(15-25(24)32-2)22(28-12-8-3-4-9-13-28)17-23(29)21(19)16-26(30)27-18-10-6-5-7-11-18/h5-7,10-11,14-15,17,29H,3-4,8-9,12-13,16H2,1-2H3,(H,27,30)