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

Systemtic Name: (E)-4-[3-[(4-methylphenyl)methyl]thiophen-2-yl]-2-oxidanyl-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-2-hydroxy-4-oxo-4-[3-(p-tolylmethyl)-2-thienyl]but-2-enoic acid CAS Name: (E)-2-hydroxy-4-[3-[(4-methylphenyl)methyl]-2-thiophenyl]-4-oxo-2-butenoic acid IUPAC Name: (E)-2-hydroxy-4-[3-[(4-methylphenyl)methyl]thiophen-2-yl]-4-oxobut-2-enoic acid Traditional Name: (E)-2-hydroxy-4-keto-4-[3-(4-methylbenzyl)-2-thienyl]but-2-enoic acid Formula: C16H14O4S MolecularWeight: 302.34496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=C(SC=C2)C(=O)C=C(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CC2=C(SC=C2)C(=O)/C=C(\C(=O)O)/O

InChI

InChI=1S/C16H14O4S/c1-10-2-4-11(5-3-10)8-12-6-7-21-15(12)13(17)9-14(18)16(19)20/h2-7,9,18H,8H2,1H3,(H,19,20)/b14-9+