4-[1-chloranyl-2-[4-(4-pentylphenyl)cyclohexyl]ethyl]-1-propyl-bicyclo[2.2.2]octane

Systemtic Name: 4-[1-chloranyl-2-[4-(4-pentylphenyl)cyclohexyl]ethyl]-1-propyl-bicyclo[2.2.2]octane Openeye Name: 4-[1-chloro-2-[4-(4-pentylphenyl)cyclohexyl]ethyl]-1-propyl-bicyclo[2.2.2]octane CAS Name: 4-[1-chloro-2-[4-(4-pentylphenyl)cyclohexyl]ethyl]-1-propylbicyclo[2.2.2]octane IUPAC Name: 4-[1-chloro-2-[4-(4-pentylphenyl)cyclohexyl]ethyl]-1-propylbicyclo[2.2.2]octane Traditional Name: 4-[2-[4-(4-amylphenyl)cyclohexyl]-1-chloro-ethyl]-1-propyl-bicyclo[2.2.2]octane Formula: C30H47Cl MolecularWeight: 443.14718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2CCC(CC2)CC(C34CCC(CC3)(CC4)CCC)Cl

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2CCC(CC2)CC(C34CCC(CC3)(CC4)CCC)Cl

InChI

InChI=1S/C30H47Cl/c1-3-5-6-7-24-8-12-26(13-9-24)27-14-10-25(11-15-27)23-28(31)30-20-17-29(16-4-2,18-21-30)19-22-30/h8-9,12-13,25,27-28H,3-7,10-11,14-23H2,1-2H3