3,4-dihydro-1H-isoquinolin-2-yl-(4-methylsulfonylphenyl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-methylsulfonylphenyl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-methylsulfonylphenyl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-methylsulfonylphenyl)methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-methylsulfonylphenyl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-mesylphenyl)methanone Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H17NO3S/c1-22(20,21)16-8-6-14(7-9-16)17(19)18-11-10-13-4-2-3-5-15(13)12-18/h2-9H,10-12H2,1H3