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

Systemtic Name: 1-[3-oxidanylidene-3-(3-propan-2-yloxypropylamino)propyl]pyrazole-4-carboxylic acid Openeye Name: 1-[3-(3-isopropoxypropylamino)-3-oxo-propyl]pyrazole-4-carboxylic acid CAS Name: 1-[3-oxo-3-(3-propan-2-yloxypropylamino)propyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[3-oxo-3-(3-propan-2-yloxypropylamino)propyl]pyrazole-4-carboxylic acid Traditional Name: 1-[3-(3-isopropoxypropylamino)-3-keto-propyl]pyrazole-4-carboxylic acid Formula: C13H21N3O4 MolecularWeight: 283.32354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)CCN1C=C(C=N1)C(=O)O

Isomeric SMILES

CC(C)OCCCNC(=O)CCN1C=C(C=N1)C(=O)O

InChI

InChI=1S/C13H21N3O4/c1-10(2)20-7-3-5-14-12(17)4-6-16-9-11(8-15-16)13(18)19/h8-10H,3-7H2,1-2H3,(H,14,17)(H,18,19)