[4-(4-octoxyphenyl)phenyl] 3-pentylcyclobutane-1-carboxylate

Systemtic Name: [4-(4-octoxyphenyl)phenyl] 3-pentylcyclobutane-1-carboxylate Openeye Name: [4-(4-octoxyphenyl)phenyl] 3-pentylcyclobutanecarboxylate CAS Name: 3-pentyl-1-cyclobutanecarboxylic acid [4-(4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(4-octoxyphenyl)phenyl] 3-pentylcyclobutane-1-carboxylate Traditional Name: 3-amylcyclobutanecarboxylic acid [4-(4-octoxyphenyl)phenyl] ester Formula: C30H42O3 MolecularWeight: 450.65268

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3CC(C3)CCCCC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3CC(C3)CCCCC

InChI

InChI=1S/C30H42O3/c1-3-5-7-8-9-11-21-32-28-17-13-25(14-18-28)26-15-19-29(20-16-26)33-30(31)27-22-24(23-27)12-10-6-4-2/h13-20,24,27H,3-12,21-23H2,1-2H3