2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(quinolin-6-ylmethylamino)-3H-isoindol-1-one

Systemtic Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(quinolin-6-ylmethylamino)-3H-isoindol-1-one Openeye Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(6-quinolylmethylamino)isoindolin-1-one CAS Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(6-quinolinylmethylamino)-3H-isoindol-1-one IUPAC Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(quinolin-6-ylmethylamino)-3H-isoindol-1-one Traditional Name: 2-(4,4-dimethyl-2,3-dihydro-1H-isoquinolin-7-yl)-7-(6-quinolylmethylamino)isoindolin-1-one Formula: C29H28N4O MolecularWeight: 448.55882

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CNCC2=C1C=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)NCC5=CC6=C(C=C5)N=CC=C6)C

Isomeric SMILES

CC1(CNCC2=C1C=CC(=C2)N3CC4=C(C3=O)C(=CC=C4)NCC5=CC6=C(C=C5)N=CC=C6)C

InChI

InChI=1S/C29H28N4O/c1-29(2)18-30-16-22-14-23(9-10-24(22)29)33-17-21-5-3-7-26(27(21)28(33)34)32-15-19-8-11-25-20(13-19)6-4-12-31-25/h3-14,30,32H,15-18H2,1-2H3