3-[(3,4-dimethoxyphenyl)methylamino]azepan-2-one

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methylamino]azepan-2-one Openeye Name: 3-[(3,4-dimethoxyphenyl)methylamino]azepan-2-one CAS Name: 3-[(3,4-dimethoxyphenyl)methylamino]-2-azepanone IUPAC Name: 3-[(3,4-dimethoxyphenyl)methylamino]azepan-2-one Traditional Name: 3-(veratrylamino)azepan-2-one Formula: C15H22N2O3 MolecularWeight: 278.34678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2CCCCNC2=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2CCCCNC2=O)OC

InChI

InChI=1S/C15H22N2O3/c1-19-13-7-6-11(9-14(13)20-2)10-17-12-5-3-4-8-16-15(12)18/h6-7,9,12,17H,3-5,8,10H2,1-2H3,(H,16,18)