1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-4-phenyl-butan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-4-phenyl-butan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-4-phenyl-butan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methyl-3-indolyl)-4-phenyl-1-butanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-4-phenylbutan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(1-methylindol-3-yl)-4-phenyl-butan-1-one Formula: C28H28N2O MolecularWeight: 408.53472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C(CC3=CC=CC=C3)CC(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C(CC3=CC=CC=C3)CC(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H28N2O/c1-29-20-26(25-13-7-8-14-27(25)29)24(17-21-9-3-2-4-10-21)18-28(31)30-16-15-22-11-5-6-12-23(22)19-30/h2-14,20,24H,15-19H2,1H3