methyl 5-bromanyl-2-ethyl-2-phenyl-pentanoate

Systemtic Name: methyl 5-bromanyl-2-ethyl-2-phenyl-pentanoate Openeye Name: methyl 5-bromo-2-ethyl-2-phenyl-pentanoate CAS Name: 5-bromo-2-ethyl-2-phenylpentanoic acid methyl ester IUPAC Name: methyl 5-bromo-2-ethyl-2-phenylpentanoate Traditional Name: 5-bromo-2-ethyl-2-phenyl-valeric acid methyl ester Formula: C14H19BrO2 MolecularWeight: 299.20346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCBr)(C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCC(CCCBr)(C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C14H19BrO2/c1-3-14(10-7-11-15,13(16)17-2)12-8-5-4-6-9-12/h4-6,8-9H,3,7,10-11H2,1-2H3