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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2CCN(CC2)CCCOC3=CC4=C(CCN(CC4)C(C)C)C=C3

Isomeric SMILES

CC1=CC=CC=C1C2CCN(CC2)CCCOC3=CC4=C(CCN(CC4)C(C)C)C=C3

InChI

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