2-[3-(dimethylamino)-2-methyl-propyl]-4-phenyl-isoquinolin-1-one

Systemtic Name: 2-[3-(dimethylamino)-2-methyl-propyl]-4-phenyl-isoquinolin-1-one Openeye Name: 2-[3-(dimethylamino)-2-methyl-propyl]-4-phenyl-isoquinolin-1-one CAS Name: 2-[3-(dimethylamino)-2-methylpropyl]-4-phenyl-1-isoquinolinone IUPAC Name: 2-[3-(dimethylamino)-2-methylpropyl]-4-phenylisoquinolin-1-one Traditional Name: 2-[3-(dimethylamino)-2-methyl-propyl]-4-phenyl-isocarbostyril Formula: C21H24N2O MolecularWeight: 320.42806

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)CN(C)C

Isomeric SMILES

CC(CN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)CN(C)C

InChI

InChI=1S/C21H24N2O/c1-16(13-22(2)3)14-23-15-20(17-9-5-4-6-10-17)18-11-7-8-12-19(18)21(23)24/h4-12,15-16H,13-14H2,1-3H3