[(2S)-1-[(E)-1-nitroprop-1-en-2-yl]sulfanylpropan-2-yl]benzene

Systemtic Name: [(2S)-1-[(E)-1-nitroprop-1-en-2-yl]sulfanylpropan-2-yl]benzene Openeye Name: [(1S)-1-methyl-2-[(E)-1-methyl-2-nitro-vinyl]sulfanyl-ethyl]benzene CAS Name: [(2S)-1-[[(E)-1-nitroprop-1-en-2-yl]thio]propan-2-yl]benzene IUPAC Name: [(2S)-1-[(E)-1-nitroprop-1-en-2-yl]sulfanylpropan-2-yl]benzene Traditional Name: [(1S)-1-methyl-2-[[(E)-1-methyl-2-nitro-vinyl]thio]ethyl]benzene Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=C[N+](=O)[O-])C)C1=CC=CC=C1

Isomeric SMILES

C[C@H](CS/C(=C/[N+](=O)[O-])/C)C1=CC=CC=C1

InChI

InChI=1S/C12H15NO2S/c1-10(12-6-4-3-5-7-12)9-16-11(2)8-13(14)15/h3-8,10H,9H2,1-2H3/b11-8+/t10-/m1/s1