(3S)-3-methyl-2-(phenylsulfonyl)-1,3-dihydroisoquinolin-4-one

Systemtic Name: (3S)-3-methyl-2-(phenylsulfonyl)-1,3-dihydroisoquinolin-4-one Openeye Name: (3S)-2-(benzenesulfonyl)-3-methyl-1,3-dihydroisoquinolin-4-one CAS Name: (3S)-2-(benzenesulfonyl)-3-methyl-1,3-dihydroisoquinolin-4-one IUPAC Name: (3S)-2-(benzenesulfonyl)-3-methyl-1,3-dihydroisoquinolin-4-one Traditional Name: (3S)-2-besyl-3-methyl-1,3-dihydroisoquinolin-4-one Formula: C16H15NO3S MolecularWeight: 301.3602

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C2=CC=CC=C2CN1S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1C(=O)C2=CC=CC=C2CN1S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H15NO3S/c1-12-16(18)15-10-6-5-7-13(15)11-17(12)21(19,20)14-8-3-2-4-9-14/h2-10,12H,11H2,1H3/t12-/m0/s1