[2-chloranyl-4-(4-pentylphenyl)phenyl] 1-propylcyclohexane-1-carboxylate

Systemtic Name: [2-chloranyl-4-(4-pentylphenyl)phenyl] 1-propylcyclohexane-1-carboxylate Openeye Name: [2-chloro-4-(4-pentylphenyl)phenyl] 1-propylcyclohexanecarboxylate CAS Name: 1-propyl-1-cyclohexanecarboxylic acid [2-chloro-4-(4-pentylphenyl)phenyl] ester IUPAC Name: [2-chloro-4-(4-pentylphenyl)phenyl] 1-propylcyclohexane-1-carboxylate Traditional Name: 1-propylcyclohexanecarboxylic acid [4-(4-amylphenyl)-2-chloro-phenyl] ester Formula: C27H35ClO2 MolecularWeight: 427.0186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3(CCCCC3)CCC)Cl

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3(CCCCC3)CCC)Cl

InChI

InChI=1S/C27H35ClO2/c1-3-5-7-10-21-11-13-22(14-12-21)23-15-16-25(24(28)20-23)30-26(29)27(17-4-2)18-8-6-9-19-27/h11-16,20H,3-10,17-19H2,1-2H3