2-nitro-N-[(2R)-1-[(S)-phenylsulfinyl]but-3-en-2-yl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[(2R)-1-[(S)-phenylsulfinyl]but-3-en-2-yl]benzenesulfonamide Openeye Name: 2-nitro-N-[(1R)-1-[[(S)-phenylsulfinyl]methyl]allyl]benzenesulfonamide CAS Name: 2-nitro-N-[(2R)-1-[(S)-phenylsulfinyl]but-3-en-2-yl]benzenesulfonamide IUPAC Name: 2-nitro-N-[(2R)-1-[(S)-phenylsulfinyl]but-3-en-2-yl]benzenesulfonamide Traditional Name: 2-nitro-N-[(1R)-1-[[(S)-phenylsulfinyl]methyl]allyl]benzenesulfonamide Formula: C16H16N2O5S2 MolecularWeight: 380.43864

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(CS(=O)C1=CC=CC=C1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O5S2/c1-2-13(12-24(21)14-8-4-3-5-9-14)17-25(22,23)16-11-7-6-10-15(16)18(19)20/h2-11,13,17H,1,12H2/t13-,24+/m1/s1