4-methylsulfonyl-3-oxidanyl-2-(phenylmethyl)isoquinolin-1-one

Systemtic Name: 4-methylsulfonyl-3-oxidanyl-2-(phenylmethyl)isoquinolin-1-one Openeye Name: 2-benzyl-3-hydroxy-4-methylsulfonyl-isoquinolin-1-one CAS Name: 3-hydroxy-4-methylsulfonyl-2-(phenylmethyl)-1-isoquinolinone IUPAC Name: 2-benzyl-3-hydroxy-4-methylsulfonylisoquinolin-1-one Traditional Name: 2-benzyl-3-hydroxy-4-mesyl-isocarbostyril Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(N(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)O

Isomeric SMILES

CS(=O)(=O)C1=C(N(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3)O

InChI

InChI=1S/C17H15NO4S/c1-23(21,22)15-13-9-5-6-10-14(13)16(19)18(17(15)20)11-12-7-3-2-4-8-12/h2-10,20H,11H2,1H3