octyl 4-(4-chlorophenyl)cyclohexene-1-carboxylate

Systemtic Name: octyl 4-(4-chlorophenyl)cyclohexene-1-carboxylate Openeye Name: octyl 4-(4-chlorophenyl)cyclohexene-1-carboxylate CAS Name: 4-(4-chlorophenyl)-1-cyclohexenecarboxylic acid octyl ester IUPAC Name: octyl 4-(4-chlorophenyl)cyclohexene-1-carboxylate Traditional Name: 4-(4-chlorophenyl)cyclohexene-1-carboxylic acid octyl ester Formula: C21H29ClO2 MolecularWeight: 348.90676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29ClO2/c1-2-3-4-5-6-7-16-24-21(23)19-10-8-17(9-11-19)18-12-14-20(22)15-13-18/h10,12-15,17H,2-9,11,16H2,1H3