ethyl 4-chloranyl-2-(2-methylphenyl)cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: ethyl 4-chloranyl-2-(2-methylphenyl)cyclohexa-2,4-diene-1-carboxylate Openeye Name: ethyl 4-chloro-2-(o-tolyl)cyclohexa-2,4-diene-1-carboxylate CAS Name: 4-chloro-2-(2-methylphenyl)-1-cyclohexa-2,4-dienecarboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-2-(2-methylphenyl)cyclohexa-2,4-diene-1-carboxylate Traditional Name: 4-chloro-2-(o-tolyl)cyclohexa-2,4-diene-1-carboxylic acid ethyl ester Formula: C16H17ClO2 MolecularWeight: 276.75798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC=C(C=C1C2=CC=CC=C2C)Cl

Isomeric SMILES

CCOC(=O)C1CC=C(C=C1C2=CC=CC=C2C)Cl

InChI

InChI=1S/C16H17ClO2/c1-3-19-16(18)14-9-8-12(17)10-15(14)13-7-5-4-6-11(13)2/h4-8,10,14H,3,9H2,1-2H3