2-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-6-methyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-6-methyl-3,4-dihydroisoquinolin-1-one Openeye Name: 2-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-6-methyl-3,4-dihydroisoquinolin-1-one CAS Name: 2-[4-[3-(dimethylamino)-1-pyrrolidinyl]phenyl]-6-methyl-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-6-methyl-3,4-dihydroisoquinolin-1-one Traditional Name: 2-[4-[3-(dimethylamino)pyrrolidino]phenyl]-6-methyl-3,4-dihydroisocarbostyril Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(CC2)C3=CC=C(C=C3)N4CCC(C4)N(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(CC2)C3=CC=C(C=C3)N4CCC(C4)N(C)C

InChI

InChI=1S/C22H27N3O/c1-16-4-9-21-17(14-16)10-13-25(22(21)26)19-7-5-18(6-8-19)24-12-11-20(15-24)23(2)3/h4-9,14,20H,10-13,15H2,1-3H3