1-methoxy-4-[(1E,3Z)-4-methylsulfonyl-4-nitro-buta-1,3-dienyl]benzene

Systemtic Name: 1-methoxy-4-[(1E,3Z)-4-methylsulfonyl-4-nitro-buta-1,3-dienyl]benzene Openeye Name: 1-methoxy-4-[(1E,3Z)-4-methylsulfonyl-4-nitro-buta-1,3-dienyl]benzene CAS Name: 1-methoxy-4-[(1E,3Z)-4-methylsulfonyl-4-nitrobuta-1,3-dienyl]benzene IUPAC Name: 1-methoxy-4-[(1E,3Z)-4-methylsulfonyl-4-nitrobuta-1,3-dienyl]benzene Traditional Name: 1-[(1E,3Z)-4-mesyl-4-nitro-buta-1,3-dienyl]-4-methoxy-benzene Formula: C12H13NO5S MolecularWeight: 283.30032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC=C([N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C=C(/[N+](=O)[O-])\S(=O)(=O)C

InChI

InChI=1S/C12H13NO5S/c1-18-11-8-6-10(7-9-11)4-3-5-12(13(14)15)19(2,16)17/h3-9H,1-2H3/b4-3+,12-5-