3-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-2H-isoquinolin-1-one

Systemtic Name: 3-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-2H-isoquinolin-1-one Openeye Name: 3-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-2H-isoquinolin-1-one CAS Name: 3-[4-(2-hydroxyethyl)-1-piperazinyl]-6-methyl-2H-isoquinolin-1-one IUPAC Name: 3-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-2H-isoquinolin-1-one Traditional Name: 3-[4-(2-hydroxyethyl)piperazino]-6-methyl-isocarbostyril Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)NC(=C2)N3CCN(CC3)CCO

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)NC(=C2)N3CCN(CC3)CCO

InChI

InChI=1S/C16H21N3O2/c1-12-2-3-14-13(10-12)11-15(17-16(14)21)19-6-4-18(5-7-19)8-9-20/h2-3,10-11,20H,4-9H2,1H3,(H,17,21)