1-[3-[(2-azanyl-2-oxidanylidene-ethyl)amino]-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[3-[(2-azanyl-2-oxidanylidene-ethyl)amino]-3-oxidanylidene-propyl]pyrazole-4-carboxylic acid Openeye Name: 1-[3-[(2-amino-2-oxo-ethyl)amino]-3-oxo-propyl]pyrazole-4-carboxylic acid CAS Name: 1-[3-[(2-amino-2-oxoethyl)amino]-3-oxopropyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[3-[(2-amino-2-oxoethyl)amino]-3-oxopropyl]pyrazole-4-carboxylic acid Traditional Name: 1-[3-[(2-amino-2-keto-ethyl)amino]-3-keto-propyl]pyrazole-4-carboxylic acid Formula: C9H12N4O4 MolecularWeight: 240.21598

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=NN1CCC(=O)NCC(=O)N)C(=O)O

Isomeric SMILES

C1=C(C=NN1CCC(=O)NCC(=O)N)C(=O)O

InChI

InChI=1S/C9H12N4O4/c10-7(14)4-11-8(15)1-2-13-5-6(3-12-13)9(16)17/h3,5H,1-2,4H2,(H2,10,14)(H,11,15)(H,16,17)