ethyl 1-methyl-4-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl 1-methyl-4-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]cyclohexane-1-carboxylate Openeye Name: ethyl 1-methyl-4-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]cyclohexanecarboxylate CAS Name: 1-methyl-4-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-4-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]cyclohexane-1-carboxylate Traditional Name: 1-methyl-4-[4-[4-(4-propylcyclohexyl)phenyl]phenyl]cyclohexanecarboxylic acid ethyl ester Formula: C31H42O2 MolecularWeight: 446.66398

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)(C)C(=O)OCC

Isomeric SMILES

CCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC=C(C=C3)C4CCC(CC4)(C)C(=O)OCC

InChI

InChI=1S/C31H42O2/c1-4-6-23-7-9-24(10-8-23)25-11-13-26(14-12-25)27-15-17-28(18-16-27)29-19-21-31(3,22-20-29)30(32)33-5-2/h11-18,23-24,29H,4-10,19-22H2,1-3H3