methyl 4-chloranyl-2-phenyl-cyclohexa-2,4-diene-1-carboxylate

Systemtic Name: methyl 4-chloranyl-2-phenyl-cyclohexa-2,4-diene-1-carboxylate Openeye Name: methyl 4-chloro-2-phenyl-cyclohexa-2,4-diene-1-carboxylate CAS Name: 4-chloro-2-phenyl-1-cyclohexa-2,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 4-chloro-2-phenylcyclohexa-2,4-diene-1-carboxylate Traditional Name: 4-chloro-2-phenyl-cyclohexa-2,4-diene-1-carboxylic acid methyl ester Formula: C14H13ClO2 MolecularWeight: 248.70482

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=C(C=C1C2=CC=CC=C2)Cl

Isomeric SMILES

COC(=O)C1CC=C(C=C1C2=CC=CC=C2)Cl

InChI

InChI=1S/C14H13ClO2/c1-17-14(16)12-8-7-11(15)9-13(12)10-5-3-2-4-6-10/h2-7,9,12H,8H2,1H3