2-methyl-4-(phenylsulfonylmethyl)isoquinolin-1-one

Systemtic Name: 2-methyl-4-(phenylsulfonylmethyl)isoquinolin-1-one Openeye Name: 4-(benzenesulfonylmethyl)-2-methyl-isoquinolin-1-one CAS Name: 4-(benzenesulfonylmethyl)-2-methyl-1-isoquinolinone IUPAC Name: 4-(benzenesulfonylmethyl)-2-methylisoquinolin-1-one Traditional Name: 4-(besylmethyl)-2-methyl-isocarbostyril Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C2C1=O)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C=C(C2=CC=CC=C2C1=O)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H15NO3S/c1-18-11-13(15-9-5-6-10-16(15)17(18)19)12-22(20,21)14-7-3-2-4-8-14/h2-11H,12H2,1H3