3-(4-methoxy-2-methyl-phenyl)-7-(3-oxidanylpiperidin-1-yl)-2H-isoquinolin-1-one

Systemtic Name: 3-(4-methoxy-2-methyl-phenyl)-7-(3-oxidanylpiperidin-1-yl)-2H-isoquinolin-1-one Openeye Name: 7-(3-hydroxy-1-piperidyl)-3-(4-methoxy-2-methyl-phenyl)-2H-isoquinolin-1-one CAS Name: 7-(3-hydroxy-1-piperidinyl)-3-(4-methoxy-2-methylphenyl)-2H-isoquinolin-1-one IUPAC Name: 7-(3-hydroxypiperidin-1-yl)-3-(4-methoxy-2-methylphenyl)-2H-isoquinolin-1-one Traditional Name: 7-(3-hydroxypiperidino)-3-(4-methoxy-2-methyl-phenyl)isocarbostyril Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC)C2=CC3=C(C=C(C=C3)N4CCCC(C4)O)C(=O)N2

Isomeric SMILES

CC1=C(C=CC(=C1)OC)C2=CC3=C(C=C(C=C3)N4CCCC(C4)O)C(=O)N2

InChI

InChI=1S/C22H24N2O3/c1-14-10-18(27-2)7-8-19(14)21-11-15-5-6-16(12-20(15)22(26)23-21)24-9-3-4-17(25)13-24/h5-8,10-12,17,25H,3-4,9,13H2,1-2H3,(H,23,26)