1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-3-(4-methylphenyl)propan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-3-(4-methylphenyl)propan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-3-(p-tolyl)propan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methyl-3-indolyl)-3-(4-methylphenyl)-1-propanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-3-(4-methylphenyl)propan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-3-(p-tolyl)propan-1-one Formula: C28H28N2O MolecularWeight: 408.53472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)N2CCC3=CC=CC=C3C2)C4=CN(C5=CC=CC=C54)C

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)N2CCC3=CC=CC=C3C2)C4=CN(C5=CC=CC=C54)C

InChI

InChI=1S/C28H28N2O/c1-20-11-13-22(14-12-20)25(26-19-29(2)27-10-6-5-9-24(26)27)17-28(31)30-16-15-21-7-3-4-8-23(21)18-30/h3-14,19,25H,15-18H2,1-2H3