4-[(4E)-4-[[5-(dimethylamino)furan-2-yl]methylidene]-3-ethanoyl-5-oxidanylidene-pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[(4E)-4-[[5-(dimethylamino)furan-2-yl]methylidene]-3-ethanoyl-5-oxidanylidene-pyrazol-1-yl]benzoic acid Openeye Name: 4-[(4E)-3-acetyl-4-[[5-(dimethylamino)-2-furyl]methylene]-5-oxo-pyrazol-1-yl]benzoic acid CAS Name: 4-[(4E)-3-acetyl-4-[[5-(dimethylamino)-2-furanyl]methylidene]-5-oxo-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4E)-3-acetyl-4-[[5-(dimethylamino)furan-2-yl]methylidene]-5-oxopyrazol-1-yl]benzoic acid Traditional Name: 4-[(4E)-3-acetyl-4-[[5-(dimethylamino)-2-furyl]methylene]-5-keto-2-pyrazolin-1-yl]benzoic acid Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN(C(=O)C1=CC2=CC=C(O2)N(C)C)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(=O)C\1=NN(C(=O)/C1=C/C2=CC=C(O2)N(C)C)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H17N3O5/c1-11(23)17-15(10-14-8-9-16(27-14)21(2)3)18(24)22(20-17)13-6-4-12(5-7-13)19(25)26/h4-10H,1-3H3,(H,25,26)/b15-10+