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

Systemtic Name: 2-(2-methoxyethyl)-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-(2-methoxyethyl)isoquinolin-1-one CAS Name: 2-(2-methoxyethyl)-5-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethoxy]-1-isoquinolinone IUPAC Name: 5-[2-(4-benzylpiperidin-1-yl)-2-oxoethoxy]-2-(2-methoxyethyl)isoquinolin-1-one Traditional Name: 5-[2-(4-benzylpiperidino)-2-keto-ethoxy]-2-(2-methoxyethyl)isocarbostyril Formula: C26H30N2O4 MolecularWeight: 434.5274

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COCCN1C=CC2=C(C1=O)C=CC=C2OCC(=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H30N2O4/c1-31-17-16-28-15-12-22-23(26(28)30)8-5-9-24(22)32-19-25(29)27-13-10-21(11-14-27)18-20-6-3-2-4-7-20/h2-9,12,15,21H,10-11,13-14,16-19H2,1H3