7-(2,3-dimethoxyphenyl)-9-methoxy-4-[(3S)-3-phenylbutyl]-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 7-(2,3-dimethoxyphenyl)-9-methoxy-4-[(3S)-3-phenylbutyl]-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(2,3-dimethoxyphenyl)-9-methoxy-4-[(3S)-3-phenylbutyl]-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(2,3-dimethoxyphenyl)-9-methoxy-4-[(3S)-3-phenylbutyl]-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(2,3-dimethoxyphenyl)-9-methoxy-4-[(3S)-3-phenylbutyl]-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(2,3-dimethoxyphenyl)-9-methoxy-4-[(3S)-3-phenylbutyl]-3,5-dihydro-2H-1,4-benzoxazepine Formula: C28H33NO4 MolecularWeight: 447.56592

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1CCOC2=C(C1)C=C(C=C2OC)C3=C(C(=CC=C3)OC)OC)C4=CC=CC=C4

Isomeric SMILES

C[C@@H](CCN1CCOC2=C(C1)C=C(C=C2OC)C3=C(C(=CC=C3)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C28H33NO4/c1-20(21-9-6-5-7-10-21)13-14-29-15-16-33-27-23(19-29)17-22(18-26(27)31-3)24-11-8-12-25(30-2)28(24)32-4/h5-12,17-18,20H,13-16,19H2,1-4H3/t20-/m0/s1