7-[3-[4-(3-methylphenyl)piperidin-1-yl]propoxy]-3-propan-2-yl-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 7-[3-[4-(3-methylphenyl)piperidin-1-yl]propoxy]-3-propan-2-yl-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 3-isopropyl-7-[3-[4-(m-tolyl)-1-piperidyl]propoxy]-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 7-[3-[4-(3-methylphenyl)-1-piperidinyl]propoxy]-3-propan-2-yl-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 7-[3-[4-(3-methylphenyl)piperidin-1-yl]propoxy]-3-propan-2-yl-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 3-isopropyl-7-[3-[4-(m-tolyl)piperidino]propoxy]-1,2,4,5-tetrahydro-3-benzazepine Formula: C28H40N2O MolecularWeight: 420.63

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CCN(CC2)CCCOC3=CC4=C(CCN(CC4)C(C)C)C=C3

Isomeric SMILES

CC1=CC=CC(=C1)C2CCN(CC2)CCCOC3=CC4=C(CCN(CC4)C(C)C)C=C3

InChI

InChI=1S/C28H40N2O/c1-22(2)30-17-12-24-8-9-28(21-27(24)13-18-30)31-19-5-14-29-15-10-25(11-16-29)26-7-4-6-23(3)20-26/h4,6-9,20-22,25H,5,10-19H2,1-3H3