5-[(6-methoxy-6-oxidanylidene-hexyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[(6-methoxy-6-oxidanylidene-hexyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-[(6-methoxy-6-oxo-hexyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-[[(6-methoxy-6-oxohexyl)amino]-oxomethyl]-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-[(6-methoxy-6-oxohexyl)carbamoyl]-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-[(6-keto-6-methoxy-hexyl)carbamoyl]-1-methyl-pyrazole-4-carboxylic acid Formula: C13H19N3O5 MolecularWeight: 297.30706

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)C(=O)NCCCCCC(=O)OC

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)C(=O)NCCCCCC(=O)OC

InChI

InChI=1S/C13H19N3O5/c1-16-11(9(8-15-16)13(19)20)12(18)14-7-5-3-4-6-10(17)21-2/h8H,3-7H2,1-2H3,(H,14,18)(H,19,20)