3,5-dimethyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)pyrazole-4-carboxylic acid

Systemtic Name: 3,5-dimethyl-1-(2-morpholin-4-yl-2-oxidanylidene-ethyl)pyrazole-4-carboxylic acid Openeye Name: 3,5-dimethyl-1-(2-morpholino-2-oxo-ethyl)pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-[2-(4-morpholinyl)-2-oxoethyl]-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-(2-morpholin-4-yl-2-oxoethyl)pyrazole-4-carboxylic acid Traditional Name: 1-(2-keto-2-morpholino-ethyl)-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C12H17N3O4 MolecularWeight: 267.28108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)N2CCOCC2)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC(=O)N2CCOCC2)C)C(=O)O

InChI

InChI=1S/C12H17N3O4/c1-8-11(12(17)18)9(2)15(13-8)7-10(16)14-3-5-19-6-4-14/h3-7H2,1-2H3,(H,17,18)