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

Systemtic Name: 7-(2,3-dimethoxyphenyl)-4-[(2,5-dimethylphenyl)methyl]-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 7-(2,3-dimethoxyphenyl)-4-[(2,5-dimethylphenyl)methyl]-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 7-(2,3-dimethoxyphenyl)-4-[(2,5-dimethylphenyl)methyl]-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 7-(2,3-dimethoxyphenyl)-4-[(2,5-dimethylphenyl)methyl]-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 7-(2,3-dimethoxyphenyl)-4-(2,5-dimethylbenzyl)-9-methoxy-3,5-dihydro-2H-1,4-benzoxazepine Formula: C27H31NO4 MolecularWeight: 433.53934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2CCOC3=C(C2)C=C(C=C3OC)C4=C(C(=CC=C4)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2CCOC3=C(C2)C=C(C=C3OC)C4=C(C(=CC=C4)OC)OC

InChI

InChI=1S/C27H31NO4/c1-18-9-10-19(2)21(13-18)16-28-11-12-32-26-22(17-28)14-20(15-25(26)30-4)23-7-6-8-24(29-3)27(23)31-5/h6-10,13-15H,11-12,16-17H2,1-5H3