5-[7,9-bis(oxidanylidene)-8-azaspiro[4.4]nonan-8-yl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[7,9-bis(oxidanylidene)-8-azaspiro[4.4]nonan-8-yl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-(7,9-dioxo-8-azaspiro[4.4]nonan-8-yl)-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-(7,9-dioxo-8-azaspiro[4.4]nonan-8-yl)-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-(7,9-dioxo-8-azaspiro[4.4]nonan-8-yl)-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-(7,9-diketo-8-azaspiro[4.4]nonan-8-yl)-1-methyl-pyrazole-4-carboxylic acid Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C(=O)O)N2C(=O)CC3(C2=O)CCCC3

Isomeric SMILES

CN1C(=C(C=N1)C(=O)O)N2C(=O)CC3(C2=O)CCCC3

InChI

InChI=1S/C13H15N3O4/c1-15-10(8(7-14-15)11(18)19)16-9(17)6-13(12(16)20)4-2-3-5-13/h7H,2-6H2,1H3,(H,18,19)