5-(2-methylbutyl)-2-octyl-5-phenyl-cyclohexa-1,3-diene

Systemtic Name: 5-(2-methylbutyl)-2-octyl-5-phenyl-cyclohexa-1,3-diene Openeye Name: 5-(2-methylbutyl)-2-octyl-5-phenyl-cyclohexa-1,3-diene CAS Name: 5-(2-methylbutyl)-2-octyl-5-phenylcyclohexa-1,3-diene IUPAC Name: 5-(2-methylbutyl)-2-octyl-5-phenylcyclohexa-1,3-diene Traditional Name: 5-(2-methylbutyl)-2-octyl-5-phenyl-cyclohexa-1,3-diene Formula: C25H38 MolecularWeight: 338.56922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CCC(C=C1)(CC(C)CC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCC1=CCC(C=C1)(CC(C)CC)C2=CC=CC=C2

InChI

InChI=1S/C25H38/c1-4-6-7-8-9-11-14-23-17-19-25(20-18-23,21-22(3)5-2)24-15-12-10-13-16-24/h10,12-13,15-19,22H,4-9,11,14,20-21H2,1-3H3