1-[2-[[(1S)-1-(2-ethylpyrazol-3-yl)ethyl]amino]-2-oxidanylidene-ethyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[2-[[(1S)-1-(2-ethylpyrazol-3-yl)ethyl]amino]-2-oxidanylidene-ethyl]pyrazole-3-carboxylic acid Openeye Name: 1-[2-[[(1S)-1-(2-ethylpyrazol-3-yl)ethyl]amino]-2-oxo-ethyl]pyrazole-3-carboxylic acid CAS Name: 1-[2-[[(1S)-1-(2-ethyl-3-pyrazolyl)ethyl]amino]-2-oxoethyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[2-[[(1S)-1-(2-ethylpyrazol-3-yl)ethyl]amino]-2-oxoethyl]pyrazole-3-carboxylic acid Traditional Name: 1-[2-[[(1S)-1-(2-ethylpyrazol-3-yl)ethyl]amino]-2-keto-ethyl]pyrazole-3-carboxylic acid Formula: C13H17N5O3 MolecularWeight: 291.30578

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C(C)NC(=O)CN2C=CC(=N2)C(=O)O

Isomeric SMILES

CCN1C(=CC=N1)[C@H](C)NC(=O)CN2C=CC(=N2)C(=O)O

InChI

InChI=1S/C13H17N5O3/c1-3-18-11(4-6-14-18)9(2)15-12(19)8-17-7-5-10(16-17)13(20)21/h4-7,9H,3,8H2,1-2H3,(H,15,19)(H,20,21)/t9-/m0/s1