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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO4S/c16-11(7-12(17)14(18)19)10-8-20-13(15-10)6-9-4-2-1-3-5-9/h1-5,7-8,16H,6H2,(H,18,19)/b11-7+