methyl 2,5-dimethyl-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrazole-4-carboxylate

Systemtic Name: methyl 2,5-dimethyl-3-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrazole-4-carboxylate Openeye Name: methyl 2,5-dimethyl-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrazole-4-carboxylate CAS Name: 2,5-dimethyl-3-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyrazole-4-carboxylic acid methyl ester IUPAC Name: methyl 2,5-dimethyl-3-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrazole-4-carboxylate Traditional Name: 5-(6-ketocyclohexa-2,4-dien-1-ylidene)-1,3-dimethyl-3-pyrazoline-4-carboxylic acid methyl ester Formula: C13H14N2O3 MolecularWeight: 246.26186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC=CC2=O)N(N1)C)C(=O)OC

Isomeric SMILES

CC1=C(C(=C2C=CC=CC2=O)N(N1)C)C(=O)OC

InChI

InChI=1S/C13H14N2O3/c1-8-11(13(17)18-3)12(15(2)14-8)9-6-4-5-7-10(9)16/h4-7,14H,1-3H3