1-(phenethylamino)pyrazole-4-carboxylic acid

Systemtic Name: 1-(phenethylamino)pyrazole-4-carboxylic acid Openeye Name: 1-(phenethylamino)pyrazole-4-carboxylic acid CAS Name: 1-(phenethylamino)-4-pyrazolecarboxylic acid IUPAC Name: 1-(phenethylamino)pyrazole-4-carboxylic acid Traditional Name: 1-(phenethylamino)pyrazole-4-carboxylic acid Formula: C12H13N3O2 MolecularWeight: 231.25052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNN2C=C(C=N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNN2C=C(C=N2)C(=O)O

InChI

InChI=1S/C12H13N3O2/c16-12(17)11-8-14-15(9-11)13-7-6-10-4-2-1-3-5-10/h1-5,8-9,13H,6-7H2,(H,16,17)