4-methylpentyl 2-bromanylbenzoate

Systemtic Name: 4-methylpentyl 2-bromanylbenzoate Openeye Name: isohexyl 2-bromobenzoate CAS Name: 2-bromobenzoic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl 2-bromobenzoate Traditional Name: 2-bromobenzoic acid isohexyl ester Formula: C13H17BrO2 MolecularWeight: 285.17688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)C1=CC=CC=C1Br

Isomeric SMILES

CC(C)CCCOC(=O)C1=CC=CC=C1Br

InChI

InChI=1S/C13H17BrO2/c1-10(2)6-5-9-16-13(15)11-7-3-4-8-12(11)14/h3-4,7-8,10H,5-6,9H2,1-2H3