4-(2-methylbutyl)-2-(4-octoxyphenyl)-1-phenyl-benzene

Systemtic Name: 4-(2-methylbutyl)-2-(4-octoxyphenyl)-1-phenyl-benzene Openeye Name: 4-(2-methylbutyl)-2-(4-octoxyphenyl)-1-phenyl-benzene CAS Name: 4-(2-methylbutyl)-2-(4-octoxyphenyl)-1-phenylbenzene IUPAC Name: 4-(2-methylbutyl)-2-(4-octoxyphenyl)-1-phenylbenzene Traditional Name: 4-(2-methylbutyl)-2-(4-octoxyphenyl)-1-phenyl-benzene Formula: C31H40O MolecularWeight: 428.6487

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=C(C=CC(=C2)CC(C)CC)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=C(C=CC(=C2)CC(C)CC)C3=CC=CC=C3

InChI

InChI=1S/C31H40O/c1-4-6-7-8-9-13-22-32-29-19-17-28(18-20-29)31-24-26(23-25(3)5-2)16-21-30(31)27-14-11-10-12-15-27/h10-12,14-21,24-25H,4-9,13,22-23H2,1-3H3