1-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-[2-oxidanylidene-2-(prop-2-ynylamino)ethyl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-oxo-2-(prop-2-ynylamino)ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[2-oxo-2-(prop-2-ynylamino)ethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[2-oxo-2-(prop-2-ynylamino)ethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-keto-2-(propargylamino)ethyl]pyrazole-4-carboxylic acid Formula: C9H9N3O3 MolecularWeight: 207.18606

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)CN1C=C(C=N1)C(=O)O

Isomeric SMILES

C#CCNC(=O)CN1C=C(C=N1)C(=O)O

InChI

InChI=1S/C9H9N3O3/c1-2-3-10-8(13)6-12-5-7(4-11-12)9(14)15/h1,4-5H,3,6H2,(H,10,13)(H,14,15)