4-[(E)-3-[4-methoxy-3-[(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanylmethyl]phenyl]-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: 4-[(E)-3-[4-methoxy-3-[(2-oxidanidyl-2-oxidanylidene-ethyl)sulfanylmethyl]phenyl]-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: 4-[(E)-3-[4-methoxy-3-[(2-oxido-2-oxo-ethyl)sulfanylmethyl]phenyl]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[4-methoxy-3-[[(2-oxido-2-oxoethyl)thio]methyl]phenyl]-3-oxoprop-1-enyl]benzoate IUPAC Name: 4-[(E)-3-[4-methoxy-3-[(2-oxido-2-oxoethyl)sulfanylmethyl]phenyl]-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-keto-3-[3-[[(2-keto-2-oxido-ethyl)thio]methyl]-4-methoxy-phenyl]prop-1-enyl]benzoate Formula: C20H16O6S-2 MolecularWeight: 384.40244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C=CC2=CC=C(C=C2)C(=O)[O-])CSCC(=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)C(=O)[O-])CSCC(=O)[O-]

InChI

InChI=1S/C20H18O6S/c1-26-18-9-7-15(10-16(18)11-27-12-19(22)23)17(21)8-4-13-2-5-14(6-3-13)20(24)25/h2-10H,11-12H2,1H3,(H,22,23)(H,24,25)/p-2/b8-4+