2-chloranyl-4-[2-[4-(4-hexylcyclohexyl)cyclohexyl]ethynyl]-1-pentyl-benzene

Systemtic Name: 2-chloranyl-4-[2-[4-(4-hexylcyclohexyl)cyclohexyl]ethynyl]-1-pentyl-benzene Openeye Name: 2-chloro-4-[2-[4-(4-hexylcyclohexyl)cyclohexyl]ethynyl]-1-pentyl-benzene CAS Name: 2-chloro-4-[2-[4-(4-hexylcyclohexyl)cyclohexyl]ethynyl]-1-pentylbenzene IUPAC Name: 2-chloro-4-[2-[4-(4-hexylcyclohexyl)cyclohexyl]ethynyl]-1-pentylbenzene Traditional Name: 1-amyl-2-chloro-4-[2-[4-(4-hexylcyclohexyl)cyclohexyl]ethynyl]benzene Formula: C31H47Cl MolecularWeight: 455.15788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1CCC(CC1)C2CCC(CC2)C#CC3=CC(=C(C=C3)CCCCC)Cl

Isomeric SMILES

CCCCCCC1CCC(CC1)C2CCC(CC2)C#CC3=CC(=C(C=C3)CCCCC)Cl

InChI

InChI=1S/C31H47Cl/c1-3-5-7-9-10-25-14-19-28(20-15-25)29-21-16-26(17-22-29)12-13-27-18-23-30(31(32)24-27)11-8-6-4-2/h18,23-26,28-29H,3-11,14-17,19-22H2,1-2H3