6,7-dimethyl-2-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one

Systemtic Name: 6,7-dimethyl-2-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Openeye Name: 6,7-dimethyl-2-[[1-(3-pyridylmethyl)pyrrolidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one CAS Name: 6,7-dimethyl-2-[[1-(3-pyridinylmethyl)-3-pyrrolidinyl]methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 6,7-dimethyl-2-[[1-(pyridin-3-ylmethyl)pyrrolidin-3-yl]methyl]-3,4-dihydroisoquinolin-1-one Traditional Name: 6,7-dimethyl-2-[[1-(3-pyridylmethyl)pyrrolidin-3-yl]methyl]-3,4-dihydroisocarbostyril Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CCN(C2=O)CC3CCN(C3)CC4=CN=CC=C4)C

Isomeric SMILES

CC1=C(C=C2C(=C1)CCN(C2=O)CC3CCN(C3)CC4=CN=CC=C4)C

InChI

InChI=1S/C22H27N3O/c1-16-10-20-6-9-25(22(26)21(20)11-17(16)2)15-19-5-8-24(14-19)13-18-4-3-7-23-12-18/h3-4,7,10-12,19H,5-6,8-9,13-15H2,1-2H3