5-[bis(cyanomethyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[bis(cyanomethyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 5-[bis(cyanomethyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid CAS Name: 5-[bis(cyanomethyl)amino]-1,3-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[bis(cyanomethyl)amino]-1,3-dimethylpyrazole-4-carboxylic acid Traditional Name: 5-[bis(cyanomethyl)amino]-1,3-dimethyl-pyrazole-4-carboxylic acid Formula: C10H11N5O2 MolecularWeight: 233.22664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)O)N(CC#N)CC#N)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)O)N(CC#N)CC#N)C

InChI

InChI=1S/C10H11N5O2/c1-7-8(10(16)17)9(14(2)13-7)15(5-3-11)6-4-12/h5-6H2,1-2H3,(H,16,17)