4-methyl-N-[(1S)-2-methylidene-1-(3-nitrophenyl)-3-oxidanylidene-butyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(1S)-2-methylidene-1-(3-nitrophenyl)-3-oxidanylidene-butyl]benzenesulfonamide Openeye Name: 4-methyl-N-[(1S)-2-methylene-1-(3-nitrophenyl)-3-oxo-butyl]benzenesulfonamide CAS Name: 4-methyl-N-[(1S)-2-methylene-1-(3-nitrophenyl)-3-oxobutyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(1S)-2-methylidene-1-(3-nitrophenyl)-3-oxobutyl]benzenesulfonamide Traditional Name: N-[(1S)-2-acetyl-1-(3-nitrophenyl)allyl]-4-methyl-benzenesulfonamide Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O5S/c1-12-7-9-17(10-8-12)26(24,25)19-18(13(2)14(3)21)15-5-4-6-16(11-15)20(22)23/h4-11,18-19H,2H2,1,3H3/t18-/m1/s1