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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N3O4/c1-10(2)20-9-3-6-14-12(17)5-8-16-11(13(18)19)4-7-15-16/h4,7,10H,3,5-6,8-9H2,1-2H3,(H,14,17)(H,18,19)