1-[(2R)-1-oxidanylidene-1-(1H-pyrazol-5-ylmethylamino)propan-2-yl]pyrazole-4-carboxylate

Systemtic Name: 1-[(2R)-1-oxidanylidene-1-(1H-pyrazol-5-ylmethylamino)propan-2-yl]pyrazole-4-carboxylate Openeye Name: 1-[(1R)-1-methyl-2-oxo-2-(1H-pyrazol-5-ylmethylamino)ethyl]pyrazole-4-carboxylate CAS Name: 1-[(2R)-1-oxo-1-(1H-pyrazol-5-ylmethylamino)propan-2-yl]-4-pyrazolecarboxylate IUPAC Name: 1-[(2R)-1-oxo-1-(1H-pyrazol-5-ylmethylamino)propan-2-yl]pyrazole-4-carboxylate Traditional Name: 1-[(1R)-2-keto-1-methyl-2-(1H-pyrazol-5-ylmethylamino)ethyl]pyrazole-4-carboxylate Formula: C11H12N5O3- MolecularWeight: 262.24468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=NN1)N2C=C(C=N2)C(=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=NN1)N2C=C(C=N2)C(=O)[O-]

InChI

InChI=1S/C11H13N5O3/c1-7(16-6-8(4-14-16)11(18)19)10(17)12-5-9-2-3-13-15-9/h2-4,6-7H,5H2,1H3,(H,12,17)(H,13,15)(H,18,19)/p-1/t7-/m1/s1