phenyl 2-[5-bromanyl-6-(4-methylphenyl)hexyl]oxirane-2-carboxylate

Systemtic Name: phenyl 2-[5-bromanyl-6-(4-methylphenyl)hexyl]oxirane-2-carboxylate Openeye Name: phenyl 2-[5-bromo-6-(p-tolyl)hexyl]oxirane-2-carboxylate CAS Name: 2-[5-bromo-6-(4-methylphenyl)hexyl]-2-oxiranecarboxylic acid phenyl ester IUPAC Name: phenyl 2-[5-bromo-6-(4-methylphenyl)hexyl]oxirane-2-carboxylate Traditional Name: 2-[5-bromo-6-(p-tolyl)hexyl]oxirane-2-carboxylic acid phenyl ester Formula: C22H25BrO3 MolecularWeight: 417.3361

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(CCCCC2(CO2)C(=O)OC3=CC=CC=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CC(CCCCC2(CO2)C(=O)OC3=CC=CC=C3)Br

InChI

InChI=1S/C22H25BrO3/c1-17-10-12-18(13-11-17)15-19(23)7-5-6-14-22(16-25-22)21(24)26-20-8-3-2-4-9-20/h2-4,8-13,19H,5-7,14-16H2,1H3