4-[(E)-2-(4-acetyloxy-3-methoxycarbonyl-phenyl)ethenyl]benzenesulfonic acid

Systemtic Name: 4-[(E)-2-(4-acetyloxy-3-methoxycarbonyl-phenyl)ethenyl]benzenesulfonic acid Openeye Name: 4-[(E)-2-(4-acetoxy-3-methoxycarbonyl-phenyl)vinyl]benzenesulfonic acid CAS Name: 4-[(E)-2-(4-acetyloxy-3-methoxycarbonylphenyl)ethenyl]benzenesulfonic acid IUPAC Name: 4-[(E)-2-(4-acetyloxy-3-methoxycarbonylphenyl)ethenyl]benzenesulfonic acid Traditional Name: 4-[(E)-2-(4-acetoxy-3-carbomethoxy-phenyl)vinyl]besylic acid Formula: C18H16O7S MolecularWeight: 376.38044

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=CC2=CC=C(C=C2)S(=O)(=O)O)C(=O)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)/C=C/C2=CC=C(C=C2)S(=O)(=O)O)C(=O)OC

InChI

InChI=1S/C18H16O7S/c1-12(19)25-17-10-7-14(11-16(17)18(20)24-2)4-3-13-5-8-15(9-6-13)26(21,22)23/h3-11H,1-2H3,(H,21,22,23)/b4-3+