(Z,2S)-4-(4-methylphenyl)sulfanyl-4-nitro-but-3-en-2-ol

Systemtic Name: (Z,2S)-4-(4-methylphenyl)sulfanyl-4-nitro-but-3-en-2-ol Openeye Name: (Z,2S)-4-nitro-4-(p-tolylsulfanyl)but-3-en-2-ol CAS Name: (Z,2S)-4-[(4-methylphenyl)thio]-4-nitro-3-buten-2-ol IUPAC Name: (Z,2S)-4-(4-methylphenyl)sulfanyl-4-nitrobut-3-en-2-ol Traditional Name: (Z,2S)-4-nitro-4-(p-tolylthio)but-3-en-2-ol Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=CC(C)O)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO3S/c1-8-3-5-10(6-4-8)16-11(12(14)15)7-9(2)13/h3-7,9,13H,1-2H3/b11-7-/t9-/m0/s1