(E)-4-[2-[(4-methoxyphenyl)methyl]thiophen-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid

Systemtic Name: (E)-4-[2-[(4-methoxyphenyl)methyl]thiophen-3-yl]-4-oxidanyl-2-oxidanylidene-but-3-enoic acid Openeye Name: (E)-4-hydroxy-4-[2-[(4-methoxyphenyl)methyl]-3-thienyl]-2-oxo-but-3-enoic acid CAS Name: (E)-4-hydroxy-4-[2-[(4-methoxyphenyl)methyl]-3-thiophenyl]-2-oxo-3-butenoic acid IUPAC Name: (E)-4-hydroxy-4-[2-[(4-methoxyphenyl)methyl]thiophen-3-yl]-2-oxobut-3-enoic acid Traditional Name: (E)-4-hydroxy-2-keto-4-(2-p-anisyl-3-thienyl)but-3-enoic acid Formula: C16H14O5S MolecularWeight: 318.34436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=C(C=CS2)C(=CC(=O)C(=O)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC2=C(C=CS2)/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C16H14O5S/c1-21-11-4-2-10(3-5-11)8-15-12(6-7-22-15)13(17)9-14(18)16(19)20/h2-7,9,17H,8H2,1H3,(H,19,20)/b13-9+