methyl (E,5R,6R)-7-(2-bromophenyl)-6-methoxy-5-methyl-hept-3-enoate

Systemtic Name: methyl (E,5R,6R)-7-(2-bromophenyl)-6-methoxy-5-methyl-hept-3-enoate Openeye Name: methyl (E,5R,6R)-7-(2-bromophenyl)-6-methoxy-5-methyl-hept-3-enoate CAS Name: (E,5R,6R)-7-(2-bromophenyl)-6-methoxy-5-methyl-3-heptenoic acid methyl ester IUPAC Name: methyl (E,5R,6R)-7-(2-bromophenyl)-6-methoxy-5-methylhept-3-enoate Traditional Name: (E,5R,6R)-7-(2-bromophenyl)-6-methoxy-5-methyl-hept-3-enoic acid methyl ester Formula: C16H21BrO3 MolecularWeight: 341.24014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CCC(=O)OC)C(CC1=CC=CC=C1Br)OC

Isomeric SMILES

C[C@H](/C=C/CC(=O)OC)[C@@H](CC1=CC=CC=C1Br)OC

InChI

InChI=1S/C16H21BrO3/c1-12(7-6-10-16(18)20-3)15(19-2)11-13-8-4-5-9-14(13)17/h4-9,12,15H,10-11H2,1-3H3/b7-6+/t12-,15-/m1/s1