2-[[3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[3-(2-furyl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methyl-butanoic acid CAS Name: 2-[[3-(2-furanyl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[3-(furan-2-yl)-4,5-dihydro-1H-pyrazol-5-yl]amino]-3-methylbutanoic acid Traditional Name: 2-[[5-(2-furyl)-2-pyrazolin-3-yl]amino]-3-methyl-butyric acid Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC1CC(=NN1)C2=CC=CO2

Isomeric SMILES

CC(C)C(C(=O)O)NC1CC(=NN1)C2=CC=CO2

InChI

InChI=1S/C12H17N3O3/c1-7(2)11(12(16)17)13-10-6-8(14-15-10)9-4-3-5-18-9/h3-5,7,10-11,13,15H,6H2,1-2H3,(H,16,17)