1-[3-[[(2S)-butan-2-yl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[3-[[(2S)-butan-2-yl]amino]-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 1-[3-[[(1S)-1-methylpropyl]amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 1-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[3-[[(2S)-butan-2-yl]amino]-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 1-[3-keto-3-[[(1S)-1-methylpropyl]amino]propyl]pyrazole-3-carboxylic acid Formula: C11H17N3O3 MolecularWeight: 239.27098

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CCN1C=CC(=N1)C(=O)O

Isomeric SMILES

CC[C@H](C)NC(=O)CCN1C=CC(=N1)C(=O)O

InChI

InChI=1S/C11H17N3O3/c1-3-8(2)12-10(15)5-7-14-6-4-9(13-14)11(16)17/h4,6,8H,3,5,7H2,1-2H3,(H,12,15)(H,16,17)/t8-/m0/s1