2-methyl-5-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethoxy]isoquinolin-1-one

Systemtic Name: 2-methyl-5-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethoxy]isoquinolin-1-one Openeye Name: 5-[2-(4-benzyl-1-piperidyl)-2-oxo-ethoxy]-2-methyl-isoquinolin-1-one CAS Name: 2-methyl-5-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethoxy]-1-isoquinolinone IUPAC Name: 5-[2-(4-benzylpiperidin-1-yl)-2-oxoethoxy]-2-methylisoquinolin-1-one Traditional Name: 5-[2-(4-benzylpiperidino)-2-keto-ethoxy]-2-methyl-isocarbostyril Formula: C24H26N2O3 MolecularWeight: 390.47484

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C(C1=O)C=CC=C2OCC(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CN1C=CC2=C(C1=O)C=CC=C2OCC(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O3/c1-25-13-12-20-21(24(25)28)8-5-9-22(20)29-17-23(27)26-14-10-19(11-15-26)16-18-6-3-2-4-7-18/h2-9,12-13,19H,10-11,14-17H2,1H3