5-[3,3-diethyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]-1-methyl-pyrazole-4-carboxylic acid

Systemtic Name: 5-[3,3-diethyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]-1-methyl-pyrazole-4-carboxylic acid Openeye Name: 5-(3,3-diethyl-2,5-dioxo-pyrrolidin-1-yl)-1-methyl-pyrazole-4-carboxylic acid CAS Name: 5-(3,3-diethyl-2,5-dioxo-1-pyrrolidinyl)-1-methyl-4-pyrazolecarboxylic acid IUPAC Name: 5-(3,3-diethyl-2,5-dioxopyrrolidin-1-yl)-1-methylpyrazole-4-carboxylic acid Traditional Name: 5-(3,3-diethyl-2,5-diketo-pyrrolidino)-1-methyl-pyrazole-4-carboxylic acid Formula: C13H17N3O4 MolecularWeight: 279.29178

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(=O)N(C1=O)C2=C(C=NN2C)C(=O)O)CC

Isomeric SMILES

CCC1(CC(=O)N(C1=O)C2=C(C=NN2C)C(=O)O)CC

InChI

InChI=1S/C13H17N3O4/c1-4-13(5-2)6-9(17)16(12(13)20)10-8(11(18)19)7-14-15(10)3/h7H,4-6H2,1-3H3,(H,18,19)