4,5-bis(oxidanylidene)-1-(phenylmethyl)pyrazole-3-carboxylic acid

Systemtic Name: 4,5-bis(oxidanylidene)-1-(phenylmethyl)pyrazole-3-carboxylic acid Openeye Name: 1-benzyl-4,5-dioxo-pyrazole-3-carboxylic acid CAS Name: 4,5-dioxo-1-(phenylmethyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-benzyl-4,5-dioxopyrazole-3-carboxylic acid Traditional Name: 1-benzyl-4,5-diketo-2-pyrazoline-3-carboxylic acid Formula: C11H8N2O4 MolecularWeight: 232.19222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C(=O)C(=N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C(=O)C(=N2)C(=O)O

InChI

InChI=1S/C11H8N2O4/c14-9-8(11(16)17)12-13(10(9)15)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,16,17)