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

Systemtic Name: 2-[3-(2-diethylaminoethylamino)-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 2-[3-(2-diethylaminoethylamino)-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 2-[3-(2-diethylaminoethylamino)-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 2-[3-(2-diethylaminoethylamino)-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 2-[3-(2-diethylaminoethylamino)-3-keto-propyl]pyrazole-3-carboxylic acid Formula: C13H22N4O3 MolecularWeight: 282.33878

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)CCN1C(=CC=N1)C(=O)O

Isomeric SMILES

CCN(CC)CCNC(=O)CCN1C(=CC=N1)C(=O)O

InChI

InChI=1S/C13H22N4O3/c1-3-16(4-2)10-8-14-12(18)6-9-17-11(13(19)20)5-7-15-17/h5,7H,3-4,6,8-10H2,1-2H3,(H,14,18)(H,19,20)