8-bromanyloctyl (3R)-3-[4-(2-methylpropyl)phenyl]butanoate

Systemtic Name: 8-bromanyloctyl (3R)-3-[4-(2-methylpropyl)phenyl]butanoate Openeye Name: 8-bromooctyl (3R)-3-(4-isobutylphenyl)butanoate CAS Name: (3R)-3-[4-(2-methylpropyl)phenyl]butanoic acid 8-bromooctyl ester IUPAC Name: 8-bromooctyl (3R)-3-[4-(2-methylpropyl)phenyl]butanoate Traditional Name: (3R)-3-(4-isobutylphenyl)butyric acid 8-bromooctyl ester Formula: C22H35BrO2 MolecularWeight: 411.4161

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)CC(=O)OCCCCCCCCBr

Isomeric SMILES

C[C@H](CC(=O)OCCCCCCCCBr)C1=CC=C(C=C1)CC(C)C

InChI

InChI=1S/C22H35BrO2/c1-18(2)16-20-10-12-21(13-11-20)19(3)17-22(24)25-15-9-7-5-4-6-8-14-23/h10-13,18-19H,4-9,14-17H2,1-3H3/t19-/m1/s1