4,5-dimethoxy-2-[(5-oxidanylidene-3-phenyl-1,2-oxazol-4-ylidene)methylamino]benzoic acid

Systemtic Name: 4,5-dimethoxy-2-[(5-oxidanylidene-3-phenyl-1,2-oxazol-4-ylidene)methylamino]benzoic acid Openeye Name: 4,5-dimethoxy-2-[(5-oxo-3-phenyl-isoxazol-4-ylidene)methylamino]benzoic acid CAS Name: 4,5-dimethoxy-2-[(5-oxo-3-phenyl-4-isoxazolylidene)methylamino]benzoic acid IUPAC Name: 4,5-dimethoxy-2-[(5-oxo-3-phenyl-1,2-oxazol-4-ylidene)methylamino]benzoic acid Traditional Name: 2-[(5-keto-3-phenyl-2-isoxazolin-4-ylidene)methylamino]-4,5-dimethoxy-benzoic acid Formula: C19H16N2O6 MolecularWeight: 368.34014

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)O)NC=C2C(=NOC2=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)O)NC=C2C(=NOC2=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H16N2O6/c1-25-15-8-12(18(22)23)14(9-16(15)26-2)20-10-13-17(21-27-19(13)24)11-6-4-3-5-7-11/h3-10,20H,1-2H3,(H,22,23)