4-[[3-(5-methylfuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[[3-(5-methylfuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[[3-(5-methyl-2-furyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzoic acid CAS Name: 2-hydroxy-4-[[3-(5-methyl-2-furanyl)-1-phenyl-4-pyrazolyl]methylideneamino]benzoic acid IUPAC Name: 2-hydroxy-4-[[3-(5-methylfuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]benzoic acid Traditional Name: 2-hydroxy-4-[[3-(5-methyl-2-furyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzoic acid Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NN(C=C2C=NC3=CC(=C(C=C3)C(=O)O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)C2=NN(C=C2C=NC3=CC(=C(C=C3)C(=O)O)O)C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O4/c1-14-7-10-20(29-14)21-15(13-25(24-21)17-5-3-2-4-6-17)12-23-16-8-9-18(22(27)28)19(26)11-16/h2-13,26H,1H3,(H,27,28)