2-chloranyl-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]-1-hexyl-benzene

Systemtic Name: 2-chloranyl-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]-1-hexyl-benzene Openeye Name: 2-chloro-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]-1-hexyl-benzene CAS Name: 2-chloro-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]-1-hexylbenzene IUPAC Name: 2-chloro-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]-1-hexylbenzene Traditional Name: 2-chloro-4-[2-[4-(4-heptylphenyl)cyclohexyl]ethynyl]-1-hexyl-benzene Formula: C33H45Cl MolecularWeight: 477.1634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2CCC(CC2)C#CC3=CC(=C(C=C3)CCCCCC)Cl

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2CCC(CC2)C#CC3=CC(=C(C=C3)CCCCCC)Cl

InChI

InChI=1S/C33H45Cl/c1-3-5-7-9-10-12-27-16-21-30(22-17-27)31-23-18-28(19-24-31)14-15-29-20-25-32(33(34)26-29)13-11-8-6-4-2/h16-17,20-22,25-26,28,31H,3-13,18-19,23-24H2,1-2H3