methyl (E)-14-(2-bromophenyl)-12-methylidene-tetradec-9-enoate

Systemtic Name: methyl (E)-14-(2-bromophenyl)-12-methylidene-tetradec-9-enoate Openeye Name: methyl (E)-14-(2-bromophenyl)-12-methylene-tetradec-9-enoate CAS Name: (E)-14-(2-bromophenyl)-12-methylene-9-tetradecenoic acid methyl ester IUPAC Name: methyl (E)-14-(2-bromophenyl)-12-methylidenetetradec-9-enoate Traditional Name: (9E)-12-[2-(2-bromophenyl)ethyl]trideca-9,12-dienoic acid methyl ester Formula: C22H31BrO2 MolecularWeight: 407.38434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCC=CCC(=C)CCC1=CC=CC=C1Br

Isomeric SMILES

COC(=O)CCCCCCC/C=C/CC(=C)CCC1=CC=CC=C1Br

InChI

InChI=1S/C22H31BrO2/c1-19(17-18-20-14-11-12-15-21(20)23)13-9-7-5-3-4-6-8-10-16-22(24)25-2/h7,9,11-12,14-15H,1,3-6,8,10,13,16-18H2,2H3/b9-7+