1-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-2-oxidanylidene-ethyl]pyrazole-4-carboxylate

Systemtic Name: 1-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-2-oxidanylidene-ethyl]pyrazole-4-carboxylate Openeye Name: 1-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-2-oxo-ethyl]pyrazole-4-carboxylate CAS Name: 1-[2-[2-(3,5-dimethyl-1-pyrazolyl)ethylamino]-2-oxoethyl]-4-pyrazolecarboxylate IUPAC Name: 1-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-2-oxoethyl]pyrazole-4-carboxylate Traditional Name: 1-[2-[2-(3,5-dimethylpyrazol-1-yl)ethylamino]-2-keto-ethyl]pyrazole-4-carboxylate Formula: C13H16N5O3- MolecularWeight: 290.29784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCNC(=O)CN2C=C(C=N2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1CCNC(=O)CN2C=C(C=N2)C(=O)[O-])C

InChI

InChI=1S/C13H17N5O3/c1-9-5-10(2)18(16-9)4-3-14-12(19)8-17-7-11(6-15-17)13(20)21/h5-7H,3-4,8H2,1-2H3,(H,14,19)(H,20,21)/p-1