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

Systemtic Name: 9-methoxy-7-(4-methylphenyl)-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: 9-methoxy-7-(p-tolyl)-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: 9-methoxy-7-(4-methylphenyl)-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: 9-methoxy-7-(4-methylphenyl)-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: 9-methoxy-7-(p-tolyl)-4-(1H-pyrrol-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepine Formula: C22H24N2O2 MolecularWeight: 348.43816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC=CN4

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(C(=C2)OC)OCCN(C3)CC4=CC=CN4

InChI

InChI=1S/C22H24N2O2/c1-16-5-7-17(8-6-16)18-12-19-14-24(15-20-4-3-9-23-20)10-11-26-22(19)21(13-18)25-2/h3-9,12-13,23H,10-11,14-15H2,1-2H3