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

Systemtic Name: 1-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]pyrazole-4-carboxylic acid Openeye Name: 1-[2-(cyclopropylmethylamino)-2-oxo-ethyl]pyrazole-4-carboxylic acid CAS Name: 1-[2-(cyclopropylmethylamino)-2-oxoethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-[2-(cyclopropylmethylamino)-2-oxoethyl]pyrazole-4-carboxylic acid Traditional Name: 1-[2-(cyclopropylmethylamino)-2-keto-ethyl]pyrazole-4-carboxylic acid Formula: C10H13N3O3 MolecularWeight: 223.22852

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)CN2C=C(C=N2)C(=O)O

Isomeric SMILES

C1CC1CNC(=O)CN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C10H13N3O3/c14-9(11-3-7-1-2-7)6-13-5-8(4-12-13)10(15)16/h4-5,7H,1-3,6H2,(H,11,14)(H,15,16)