1-[3-(2-morpholin-4-ylethylamino)-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[3-(2-morpholin-4-ylethylamino)-3-oxidanylidene-propyl]pyrazole-3-carboxylic acid Openeye Name: 1-[3-(2-morpholinoethylamino)-3-oxo-propyl]pyrazole-3-carboxylic acid CAS Name: 1-[3-[2-(4-morpholinyl)ethylamino]-3-oxopropyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[3-(2-morpholin-4-ylethylamino)-3-oxopropyl]pyrazole-3-carboxylic acid Traditional Name: 1-[3-keto-3-(2-morpholinoethylamino)propyl]pyrazole-3-carboxylic acid Formula: C13H20N4O4 MolecularWeight: 296.3223

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)CCN2C=CC(=N2)C(=O)O

Isomeric SMILES

C1COCCN1CCNC(=O)CCN2C=CC(=N2)C(=O)O

InChI

InChI=1S/C13H20N4O4/c18-12(14-3-6-16-7-9-21-10-8-16)2-5-17-4-1-11(15-17)13(19)20/h1,4H,2-3,5-10H2,(H,14,18)(H,19,20)