methyl (E)-6-(3-bromophenyl)-3-methyl-hex-5-enoate

Systemtic Name: methyl (E)-6-(3-bromophenyl)-3-methyl-hex-5-enoate Openeye Name: methyl (E)-6-(3-bromophenyl)-3-methyl-hex-5-enoate CAS Name: (E)-6-(3-bromophenyl)-3-methyl-5-hexenoic acid methyl ester IUPAC Name: methyl (E)-6-(3-bromophenyl)-3-methylhex-5-enoate Traditional Name: (E)-6-(3-bromophenyl)-3-methyl-hex-5-enoic acid methyl ester Formula: C14H17BrO2 MolecularWeight: 297.18758

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=CC1=CC(=CC=C1)Br)CC(=O)OC

Isomeric SMILES

CC(C/C=C/C1=CC(=CC=C1)Br)CC(=O)OC

InChI

InChI=1S/C14H17BrO2/c1-11(9-14(16)17-2)5-3-6-12-7-4-8-13(15)10-12/h3-4,6-8,10-11H,5,9H2,1-2H3/b6-3+