4-[[(5E)-5-[(3-bromanyl-4-methoxy-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid

Systemtic Name: 4-[[(5E)-5-[(3-bromanyl-4-methoxy-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]amino]benzoic acid Openeye Name: 4-[[(5E)-5-[(3-bromo-4-methoxy-phenyl)methylene]-4-oxo-thiazol-2-yl]amino]benzoic acid CAS Name: 4-[[(5E)-5-[(3-bromo-4-methoxyphenyl)methylidene]-4-oxo-2-thiazolyl]amino]benzoic acid IUPAC Name: 4-[[(5E)-5-[(3-bromo-4-methoxyphenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]amino]benzoic acid Traditional Name: 4-[[(5E)-5-(3-bromo-4-methoxy-benzylidene)-4-keto-2-thiazolin-2-yl]amino]benzoic acid Formula: C18H13BrN2O4S MolecularWeight: 433.27582

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2C(=O)N=C(S2)NC3=CC=C(C=C3)C(=O)O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/2\C(=O)N=C(S2)NC3=CC=C(C=C3)C(=O)O)Br

InChI

InChI=1S/C18H13BrN2O4S/c1-25-14-7-2-10(8-13(14)19)9-15-16(22)21-18(26-15)20-12-5-3-11(4-6-12)17(23)24/h2-9H,1H3,(H,23,24)(H,20,21,22)/b15-9+