methyl 4-chloranyl-2-(4-methylphenyl)cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: methyl 4-chloranyl-2-(4-methylphenyl)cyclohexa-1,3-diene-1-carboxylate Openeye Name: methyl 4-chloro-2-(p-tolyl)cyclohexa-1,3-diene-1-carboxylate CAS Name: 4-chloro-2-(4-methylphenyl)-1-cyclohexa-1,3-dienecarboxylic acid methyl ester IUPAC Name: methyl 4-chloro-2-(4-methylphenyl)cyclohexa-1,3-diene-1-carboxylate Traditional Name: 4-chloro-2-(p-tolyl)cyclohexa-1,3-diene-1-carboxylic acid methyl ester Formula: C15H15ClO2 MolecularWeight: 262.7314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(CCC(=C2)Cl)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(CCC(=C2)Cl)C(=O)OC

InChI

InChI=1S/C15H15ClO2/c1-10-3-5-11(6-4-10)14-9-12(16)7-8-13(14)15(17)18-2/h3-6,9H,7-8H2,1-2H3