8-methoxy-3-methyl-7-[4-[4-(4-methylphenyl)piperidin-1-yl]phenyl]sulfonyl-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 8-methoxy-3-methyl-7-[4-[4-(4-methylphenyl)piperidin-1-yl]phenyl]sulfonyl-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 8-methoxy-3-methyl-7-[4-[4-(p-tolyl)-1-piperidyl]phenyl]sulfonyl-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 8-methoxy-3-methyl-7-[4-[4-(4-methylphenyl)-1-piperidinyl]phenyl]sulfonyl-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 8-methoxy-3-methyl-7-[4-[4-(4-methylphenyl)piperidin-1-yl]phenyl]sulfonyl-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 8-methoxy-3-methyl-7-[4-[4-(p-tolyl)piperidino]phenyl]sulfonyl-1,2,4,5-tetrahydro-3-benzazepine Formula: C30H36N2O3S MolecularWeight: 504.68344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C4=C(C=C5CCN(CCC5=C4)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2CCN(CC2)C3=CC=C(C=C3)S(=O)(=O)C4=C(C=C5CCN(CCC5=C4)C)OC

InChI

InChI=1S/C30H36N2O3S/c1-22-4-6-23(7-5-22)24-14-18-32(19-15-24)27-8-10-28(11-9-27)36(33,34)30-21-26-13-17-31(2)16-12-25(26)20-29(30)35-3/h4-11,20-21,24H,12-19H2,1-3H3