N-[(2S)-1-(4-hydroxyphenyl)-3-oxidanylidene-propan-2-yl]-N-methyl-4-nitro-benzenesulfonamide

Systemtic Name: N-[(2S)-1-(4-hydroxyphenyl)-3-oxidanylidene-propan-2-yl]-N-methyl-4-nitro-benzenesulfonamide Openeye Name: N-[(1S)-1-formyl-2-(4-hydroxyphenyl)ethyl]-N-methyl-4-nitro-benzenesulfonamide CAS Name: N-[(2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-yl]-N-methyl-4-nitrobenzenesulfonamide IUPAC Name: N-[(2S)-1-(4-hydroxyphenyl)-3-oxopropan-2-yl]-N-methyl-4-nitrobenzenesulfonamide Traditional Name: N-[(1S)-1-formyl-2-(4-hydroxyphenyl)ethyl]-N-methyl-4-nitro-benzenesulfonamide Formula: C16H16N2O6S MolecularWeight: 364.37304

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC=C(C=C1)O)C=O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN([C@@H](CC1=CC=C(C=C1)O)C=O)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O6S/c1-17(14(11-19)10-12-2-6-15(20)7-3-12)25(23,24)16-8-4-13(5-9-16)18(21)22/h2-9,11,14,20H,10H2,1H3/t14-/m0/s1