1-[(3,4-dimethoxyphenyl)methyl]-7-methoxy-8-phenylmethoxy-2,3,4,5-tetrahydro-1H-2-benzazepine

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-7-methoxy-8-phenylmethoxy-2,3,4,5-tetrahydro-1H-2-benzazepine Openeye Name: 8-benzyloxy-1-[(3,4-dimethoxyphenyl)methyl]-7-methoxy-2,3,4,5-tetrahydro-1H-2-benzazepine CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-7-methoxy-8-phenylmethoxy-2,3,4,5-tetrahydro-1H-2-benzazepine IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-7-methoxy-8-phenylmethoxy-2,3,4,5-tetrahydro-1H-2-benzazepine Traditional Name: 8-benzoxy-7-methoxy-1-veratryl-2,3,4,5-tetrahydro-1H-2-benzazepine Formula: C27H31NO4 MolecularWeight: 433.53934

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCCN2)OC)OCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC2C3=CC(=C(C=C3CCCN2)OC)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C27H31NO4/c1-29-24-12-11-20(15-25(24)30-2)14-23-22-17-27(32-18-19-8-5-4-6-9-19)26(31-3)16-21(22)10-7-13-28-23/h4-6,8-9,11-12,15-17,23,28H,7,10,13-14,18H2,1-3H3