2-[3-oxidanylidene-3-(1-pyrazol-1-ylpropan-2-ylamino)propyl]pyrazole-3-carboxylic acid

Systemtic Name: 2-[3-oxidanylidene-3-(1-pyrazol-1-ylpropan-2-ylamino)propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-[(1-methyl-2-pyrazol-1-yl-ethyl)amino]-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-oxo-3-[1-(1-pyrazolyl)propan-2-ylamino]propyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-oxo-3-(1-pyrazol-1-ylpropan-2-ylamino)propyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-keto-3-[(1-methyl-2-pyrazol-1-yl-ethyl)amino]propyl]pyrazole-3-carboxylic acid Formula: C13H17N5O3 MolecularWeight: 291.30578

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=CC=N1)NC(=O)CCN2C(=CC=N2)C(=O)O

Isomeric SMILES

CC(CN1C=CC=N1)NC(=O)CCN2C(=CC=N2)C(=O)O

InChI

InChI=1S/C13H17N5O3/c1-10(9-17-7-2-5-14-17)16-12(19)4-8-18-11(13(20)21)3-6-15-18/h2-3,5-7,10H,4,8-9H2,1H3,(H,16,19)(H,20,21)