3,5-dimethyl-1-[2-oxidanylidene-2-(propylamino)ethyl]pyrazole-4-carboxylic acid

Systemtic Name: 3,5-dimethyl-1-[2-oxidanylidene-2-(propylamino)ethyl]pyrazole-4-carboxylic acid Openeye Name: 3,5-dimethyl-1-[2-oxo-2-(propylamino)ethyl]pyrazole-4-carboxylic acid CAS Name: 3,5-dimethyl-1-[2-oxo-2-(propylamino)ethyl]-4-pyrazolecarboxylic acid IUPAC Name: 3,5-dimethyl-1-[2-oxo-2-(propylamino)ethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-keto-2-(propylamino)ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C11H17N3O3 MolecularWeight: 239.27098

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN1C(=C(C(=N1)C)C(=O)O)C

Isomeric SMILES

CCCNC(=O)CN1C(=C(C(=N1)C)C(=O)O)C

InChI

InChI=1S/C11H17N3O3/c1-4-5-12-9(15)6-14-8(3)10(11(16)17)7(2)13-14/h4-6H2,1-3H3,(H,12,15)(H,16,17)