3-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 3-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 3-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 3-[[(4-ethoxycarbonyl-1H-pyrazol-5-yl)amino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 3-[(4-ethoxycarbonyl-1H-pyrazol-5-yl)carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 3-[(4-carbethoxy-1H-pyrazol-5-yl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C12H13N5O5 MolecularWeight: 307.26212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1)NC(=O)C2=NN(C=C2C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(NN=C1)NC(=O)C2=NN(C=C2C(=O)O)C

InChI

InChI=1S/C12H13N5O5/c1-3-22-12(21)6-4-13-15-9(6)14-10(18)8-7(11(19)20)5-17(2)16-8/h4-5H,3H2,1-2H3,(H,19,20)(H2,13,14,15,18)