(4-bromophenyl)methyl 2-[4-(4-pentylcyclohexyl)phenyl]ethanoate

Systemtic Name: (4-bromophenyl)methyl 2-[4-(4-pentylcyclohexyl)phenyl]ethanoate Openeye Name: (4-bromophenyl)methyl 2-[4-(4-pentylcyclohexyl)phenyl]acetate CAS Name: 2-[4-(4-pentylcyclohexyl)phenyl]acetic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 2-[4-(4-pentylcyclohexyl)phenyl]acetate Traditional Name: 2-[4-(4-amylcyclohexyl)phenyl]acetic acid (4-bromobenzyl) ester Formula: C26H33BrO2 MolecularWeight: 457.44302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)CC(=O)OCC3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)CC(=O)OCC3=CC=C(C=C3)Br

InChI

InChI=1S/C26H33BrO2/c1-2-3-4-5-20-6-12-23(13-7-20)24-14-8-21(9-15-24)18-26(28)29-19-22-10-16-25(27)17-11-22/h8-11,14-17,20,23H,2-7,12-13,18-19H2,1H3