1-[(2S)-1-(diethylamino)-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[(2S)-1-(diethylamino)-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylic acid Openeye Name: 1-[(1S)-2-(diethylamino)-1-methyl-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[(2S)-1-(diethylamino)-1-oxopropan-2-yl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[(2S)-1-(diethylamino)-1-oxopropan-2-yl]pyrazole-4-carboxylic acid Traditional Name: 1-[(1S)-2-(diethylamino)-2-keto-1-methyl-ethyl]pyrazole-4-carboxylic acid Formula: C11H17N3O3 MolecularWeight: 239.27098

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(C)N1C=C(C=N1)C(=O)O

Isomeric SMILES

CCN(CC)C(=O)[C@H](C)N1C=C(C=N1)C(=O)O

InChI

InChI=1S/C11H17N3O3/c1-4-13(5-2)10(15)8(3)14-7-9(6-12-14)11(16)17/h6-8H,4-5H2,1-3H3,(H,16,17)/t8-/m0/s1