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

Systemtic Name: 4-methyl-2-[[(5Z)-5-[(3-nitrophenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-methyl-2-[[(5Z)-5-[(3-nitrophenyl)methylene]-4-oxo-thiazol-2-yl]amino]benzoic acid CAS Name: 4-methyl-2-[[(5Z)-5-[(3-nitrophenyl)methylidene]-4-oxo-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-methyl-2-[[(5Z)-5-[(3-nitrophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 2-[[(5Z)-4-keto-5-(3-nitrobenzylidene)-2-thiazolin-2-yl]amino]-4-methyl-benzoic acid Formula: C18H13N3O5S MolecularWeight: 383.37792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H13N3O5S/c1-10-5-6-13(17(23)24)14(7-10)19-18-20-16(22)15(27-18)9-11-3-2-4-12(8-11)21(25)26/h2-9H,1H3,(H,23,24)(H,19,20,22)/b15-9-