1-[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-(3-isopropoxypropylamino)-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[2-oxo-2-(3-propan-2-yloxypropylamino)ethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-(3-isopropoxypropylamino)-2-keto-ethyl]pyrazole-4-carboxylic acid Formula: C12H19N3O4 MolecularWeight: 269.29696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CN1C=C(C=N1)C(=O)O

Isomeric SMILES

CC(C)OCCCNC(=O)CN1C=C(C=N1)C(=O)O

InChI

InChI=1S/C12H19N3O4/c1-9(2)19-5-3-4-13-11(16)8-15-7-10(6-14-15)12(17)18/h6-7,9H,3-5,8H2,1-2H3,(H,13,16)(H,17,18)