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

Systemtic Name: (E)-4-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]amino]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[[4-(4-nitrophenyl)thiazol-2-yl]amino]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[4-(4-nitrophenyl)-2-thiazolyl]amino]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[[4-(4-nitrophenyl)-1,3-thiazol-2-yl]amino]-4-oxobut-2-enoic acid Traditional Name: (E)-4-keto-4-[[4-(4-nitrophenyl)thiazol-2-yl]amino]but-2-enoic acid Formula: C13H9N3O5S MolecularWeight: 319.29266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)C=CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CSC(=N2)NC(=O)/C=C/C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O5S/c17-11(5-6-12(18)19)15-13-14-10(7-22-13)8-1-3-9(4-2-8)16(20)21/h1-7H,(H,18,19)(H,14,15,17)/b6-5+