3-[3-(dimethylamino)pyrrolidin-1-yl]-5-methyl-2H-isoquinolin-1-one

Systemtic Name: 3-[3-(dimethylamino)pyrrolidin-1-yl]-5-methyl-2H-isoquinolin-1-one Openeye Name: 3-[3-(dimethylamino)pyrrolidin-1-yl]-5-methyl-2H-isoquinolin-1-one CAS Name: 3-[3-(dimethylamino)-1-pyrrolidinyl]-5-methyl-2H-isoquinolin-1-one IUPAC Name: 3-[3-(dimethylamino)pyrrolidin-1-yl]-5-methyl-2H-isoquinolin-1-one Traditional Name: 3-[3-(dimethylamino)pyrrolidino]-5-methyl-isocarbostyril Formula: C16H21N3O MolecularWeight: 271.35744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1C=C(NC2=O)N3CCC(C3)N(C)C

Isomeric SMILES

CC1=CC=CC2=C1C=C(NC2=O)N3CCC(C3)N(C)C

InChI

InChI=1S/C16H21N3O/c1-11-5-4-6-13-14(11)9-15(17-16(13)20)19-8-7-12(10-19)18(2)3/h4-6,9,12H,7-8,10H2,1-3H3,(H,17,20)