1-[1-(3-methoxypropylamino)-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-pyrazole-4-carboxylic acid

Systemtic Name: 1-[1-(3-methoxypropylamino)-1-oxidanylidene-propan-2-yl]-3,5-dimethyl-pyrazole-4-carboxylic acid Openeye Name: 1-[2-(3-methoxypropylamino)-1-methyl-2-oxo-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid CAS Name: 1-[1-(3-methoxypropylamino)-1-oxopropan-2-yl]-3,5-dimethyl-4-pyrazolecarboxylic acid IUPAC Name: 1-[1-(3-methoxypropylamino)-1-oxopropan-2-yl]-3,5-dimethylpyrazole-4-carboxylic acid Traditional Name: 1-[2-keto-2-(3-methoxypropylamino)-1-methyl-ethyl]-3,5-dimethyl-pyrazole-4-carboxylic acid Formula: C13H21N3O4 MolecularWeight: 283.32354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(C)C(=O)NCCCOC)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1C(C)C(=O)NCCCOC)C)C(=O)O

InChI

InChI=1S/C13H21N3O4/c1-8-11(13(18)19)9(2)16(15-8)10(3)12(17)14-6-5-7-20-4/h10H,5-7H2,1-4H3,(H,14,17)(H,18,19)