4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-homoveratryl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Formula: C20H25NO4 MolecularWeight: 343.4168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OCCN(C2)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=CC2=C(C=C1)OCCN(C2)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H25NO4/c1-22-17-5-7-18-16(13-17)14-21(10-11-25-18)9-8-15-4-6-19(23-2)20(12-15)24-3/h4-7,12-13H,8-11,14H2,1-3H3