5-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)pentanoic acid

Systemtic Name: 5-(3-methyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)pentanoic acid Openeye Name: 5-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)pentanoic acid CAS Name: 5-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)pentanoic acid IUPAC Name: 5-(3-methyl-5-oxo-1,2-dihydropyrazol-4-yl)pentanoic acid Traditional Name: 5-(3-keto-5-methyl-3-pyrazolin-4-yl)valeric acid Formula: C9H14N2O3 MolecularWeight: 198.21906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN1)CCCCC(=O)O

Isomeric SMILES

CC1=C(C(=O)NN1)CCCCC(=O)O

InChI

InChI=1S/C9H14N2O3/c1-6-7(9(14)11-10-6)4-2-3-5-8(12)13/h2-5H2,1H3,(H,12,13)(H2,10,11,14)