(E)-2-oxidanyl-4-oxidanylidene-4-[4-(phenylmethyl)-1,3-thiazol-2-yl]but-2-enoic acid

Systemtic Name: (E)-2-oxidanyl-4-oxidanylidene-4-[4-(phenylmethyl)-1,3-thiazol-2-yl]but-2-enoic acid Openeye Name: (E)-4-(4-benzylthiazol-2-yl)-2-hydroxy-4-oxo-but-2-enoic acid CAS Name: (E)-2-hydroxy-4-oxo-4-[4-(phenylmethyl)-2-thiazolyl]-2-butenoic acid IUPAC Name: (E)-4-(4-benzyl-1,3-thiazol-2-yl)-2-hydroxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-(4-benzylthiazol-2-yl)-2-hydroxy-4-keto-but-2-enoic acid Formula: C14H11NO4S MolecularWeight: 289.30644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CSC(=N2)C(=O)C=C(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CSC(=N2)C(=O)/C=C(\C(=O)O)/O

InChI

InChI=1S/C14H11NO4S/c16-11(7-12(17)14(18)19)13-15-10(8-20-13)6-9-4-2-1-3-5-9/h1-5,7-8,17H,6H2,(H,18,19)/b12-7+