2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)-4-prop-1-ynyl-benzene

Systemtic Name: 2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)-4-prop-1-ynyl-benzene Openeye Name: 2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)-4-prop-1-ynyl-benzene CAS Name: 2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)-4-prop-1-ynylbenzene IUPAC Name: 2-[2-(4-pentylcyclohexyl)ethyl]-1-(2-phenylethynyl)-4-prop-1-ynylbenzene Traditional Name: 2-[2-(4-amylcyclohexyl)ethyl]-1-(2-phenylethynyl)-4-prop-1-ynyl-benzene Formula: C30H36 MolecularWeight: 396.60684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCC2=C(C=CC(=C2)C#CC)C#CC3=CC=CC=C3

Isomeric SMILES

CCCCCC1CCC(CC1)CCC2=C(C=CC(=C2)C#CC)C#CC3=CC=CC=C3

InChI

InChI=1S/C30H36/c1-3-5-7-11-26-14-16-27(17-15-26)19-23-30-24-28(10-4-2)20-22-29(30)21-18-25-12-8-6-9-13-25/h6,8-9,12-13,20,22,24,26-27H,3,5,7,11,14-17,19,23H2,1-2H3