2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one

Systemtic Name: 2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxidanylidene-pentan-2-yl]-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one Openeye Name: 2-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-butyl]-3-[1-methyl-2-(p-tolyl)indol-3-yl]isoindolin-1-one CAS Name: 2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxopentan-2-yl]-3-[1-methyl-2-(4-methylphenyl)-3-indolyl]-3H-isoindol-1-one IUPAC Name: 2-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-methyl-1-oxopentan-2-yl]-3-[1-methyl-2-(4-methylphenyl)indol-3-yl]-3H-isoindol-1-one Traditional Name: 2-[1-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-3-methyl-butyl]-3-[1-methyl-2-(p-tolyl)indol-3-yl]isoindolin-1-one Formula: C39H39N3O2 MolecularWeight: 581.74586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2C)C4C5=CC=CC=C5C(=O)N4C(CC(C)C)C(=O)N6CCC7=CC=CC=C7C6

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2C)C4C5=CC=CC=C5C(=O)N4C(CC(C)C)C(=O)N6CCC7=CC=CC=C7C6

InChI

InChI=1S/C39H39N3O2/c1-25(2)23-34(39(44)41-22-21-27-11-5-6-12-29(27)24-41)42-37(30-13-7-8-14-31(30)38(42)43)35-32-15-9-10-16-33(32)40(4)36(35)28-19-17-26(3)18-20-28/h5-20,25,34,37H,21-24H2,1-4H3