4-(1H-indol-2-ylmethyl)-9-methoxy-7-(2-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: 4-(1H-indol-2-ylmethyl)-9-methoxy-7-(2-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 4-(1H-indol-2-ylmethyl)-9-methoxy-7-(o-tolyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 4-(1H-indol-2-ylmethyl)-9-methoxy-7-(2-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 4-(1H-indol-2-ylmethyl)-9-methoxy-7-(2-methylphenyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 4-(1H-indol-2-ylmethyl)-9-methoxy-7-(o-tolyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C26H26N2O2 MolecularWeight: 398.49684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC=CC=C1C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC5=CC=CC=C5N4

InChI

InChI=1S/C26H26N2O2/c1-18-7-3-5-9-23(18)20-13-21-16-28(11-12-30-26(21)25(15-20)29-2)17-22-14-19-8-4-6-10-24(19)27-22/h3-10,13-15,27H,11-12,16-17H2,1-2H3