[(2S)-1-[(S)-[(Z)-1-nitroprop-1-en-2-yl]sulfinyl]propan-2-yl]benzene

Systemtic Name: [(2S)-1-[(S)-[(Z)-1-nitroprop-1-en-2-yl]sulfinyl]propan-2-yl]benzene Openeye Name: [(1S)-1-methyl-2-[(S)-[(Z)-1-methyl-2-nitro-vinyl]sulfinyl]ethyl]benzene CAS Name: [(2S)-1-[(S)-[(Z)-1-nitroprop-1-en-2-yl]sulfinyl]propan-2-yl]benzene IUPAC Name: [(2S)-1-[(S)-[(Z)-1-nitroprop-1-en-2-yl]sulfinyl]propan-2-yl]benzene Traditional Name: [(1S)-1-methyl-2-[(S)-[(Z)-1-methyl-2-nitro-vinyl]sulfinyl]ethyl]benzene Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3S/c1-10(12-6-4-3-5-7-12)9-17(16)11(2)8-13(14)15/h3-8,10H,9H2,1-2H3/b11-8-/t10-,17+/m1/s1