4-[[3-(furan-2-yl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-(furan-2-yl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-(2-furyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]-4-oxo-butanoic acid CAS Name: 4-[[3-(2-furanyl)-1-phenyl-4-pyrazolyl]methyl-methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[3-(furan-2-yl)-1-phenylpyrazol-4-yl]methyl-methylamino]-4-oxobutanoic acid Traditional Name: 4-[[3-(2-furyl)-1-phenyl-pyrazol-4-yl]methyl-methyl-amino]-4-keto-butyric acid Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=CO2)C3=CC=CC=C3)C(=O)CCC(=O)O

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=CO2)C3=CC=CC=C3)C(=O)CCC(=O)O

InChI

InChI=1S/C19H19N3O4/c1-21(17(23)9-10-18(24)25)12-14-13-22(15-6-3-2-4-7-15)20-19(14)16-8-5-11-26-16/h2-8,11,13H,9-10,12H2,1H3,(H,24,25)