N-phenylmethanesulfonamide; phenyl-(4-sulfonylpiperidin-1-yl)methanone

Systemtic Name: N-phenylmethanesulfonamide; phenyl-(4-sulfonylpiperidin-1-yl)methanone Openeye Name: N-phenylmethanesulfonamide; phenyl-(4-sulfonyl-1-piperidyl)methanone CAS Name: N-phenylmethanesulfonamide; phenyl-(4-sulfonyl-1-piperidinyl)methanone IUPAC Name: N-phenylmethanesulfonamide; phenyl-(4-sulfonylpiperidin-1-yl)methanone Traditional Name: N-phenylmethanesulfonamide; phenyl-(4-sulfonylpiperidino)methanone Formula: C19H22N2O5S2 MolecularWeight: 422.51838

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC=C1.C1CN(CCC1=S(=O)=O)C(=O)C2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC=C1.C1CN(CCC1=S(=O)=O)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H13NO3S.C7H9NO2S/c14-12(10-4-2-1-3-5-10)13-8-6-11(7-9-13)17(15)16;1-11(9,10)8-7-5-3-2-4-6-7/h1-5H,6-9H2;2-6,8H,1H3