4-methyl-2-[[(5Z)-5-[(5-nitro-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-methyl-2-[[(5Z)-5-[(5-nitro-2-oxidanyl-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 2-[[(5Z)-5-[(2-hydroxy-5-nitro-phenyl)methylene]-4-oxo-thiazol-2-yl]amino]-4-methyl-benzoic acid CAS Name: 2-[[(5Z)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-4-oxo-2-thiazolyl]amino]-4-methylbenzoic acid IUPAC Name: 2-[[(5Z)-5-[(2-hydroxy-5-nitrophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]-4-methylbenzoic acid Traditional Name: 2-[[(5Z)-5-(2-hydroxy-5-nitro-benzylidene)-4-keto-2-thiazolin-2-yl]amino]-4-methyl-benzoic acid Formula: C18H13N3O6S MolecularWeight: 399.37732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)O)NC2=NC(=O)C(=CC3=C(C=CC(=C3)[N+](=O)[O-])O)S2

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)O)NC2=NC(=O)/C(=C/C3=C(C=CC(=C3)[N+](=O)[O-])O)/S2

InChI

InChI=1S/C18H13N3O6S/c1-9-2-4-12(17(24)25)13(6-9)19-18-20-16(23)15(28-18)8-10-7-11(21(26)27)3-5-14(10)22/h2-8,22H,1H3,(H,24,25)(H,19,20,23)/b15-8-