[(5Z)-2-(4-chlorophenyl)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrazol-3-yl] butanoate

Systemtic Name: [(5Z)-2-(4-chlorophenyl)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyrazol-3-yl] butanoate Openeye Name: [(5Z)-2-(4-chlorophenyl)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrazol-3-yl] butanoate CAS Name: butanoic acid [(5Z)-2-(4-chlorophenyl)-5-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyrazol-3-yl] ester IUPAC Name: [(5Z)-2-(4-chlorophenyl)-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyrazol-3-yl] butanoate Traditional Name: butyric acid [(5Z)-2-(4-chlorophenyl)-5-(6-ketocyclohexa-2,4-dien-1-ylidene)-3-pyrazolin-3-yl] ester Formula: C19H17ClN2O3 MolecularWeight: 356.80288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC(=C2C=CC=CC2=O)NN1C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC(=O)OC1=C/C(=C/2\C=CC=CC2=O)/NN1C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClN2O3/c1-2-5-19(24)25-18-12-16(15-6-3-4-7-17(15)23)21-22(18)14-10-8-13(20)9-11-14/h3-4,6-12,21H,2,5H2,1H3/b16-15-