1-methyl-5-[[(2S)-3-methyl-1-oxidanidyl-1-oxidanylidene-butan-2-yl]carbamoyl]pyrazole-4-carboxylate

Systemtic Name: 1-methyl-5-[[(2S)-3-methyl-1-oxidanidyl-1-oxidanylidene-butan-2-yl]carbamoyl]pyrazole-4-carboxylate Openeye Name: 5-[[(1S)-1-carboxylato-2-methyl-propyl]carbamoyl]-1-methyl-pyrazole-4-carboxylate CAS Name: 1-methyl-5-[[[(2S)-3-methyl-1-oxido-1-oxobutan-2-yl]amino]-oxomethyl]-4-pyrazolecarboxylate IUPAC Name: 1-methyl-5-[[(2S)-3-methyl-1-oxido-1-oxobutan-2-yl]carbamoyl]pyrazole-4-carboxylate Traditional Name: 5-[[(1S)-1-carboxylato-2-methyl-propyl]carbamoyl]-1-methyl-pyrazole-4-carboxylate Formula: C11H13N3O5-2 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])NC(=O)C1=C(C=NN1C)C(=O)[O-]

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])NC(=O)C1=C(C=NN1C)C(=O)[O-]

InChI

InChI=1S/C11H15N3O5/c1-5(2)7(11(18)19)13-9(15)8-6(10(16)17)4-12-14(8)3/h4-5,7H,1-3H3,(H,13,15)(H,16,17)(H,18,19)/p-2/t7-/m0/s1