methyl (1R,2R)-2-[2-(2-bromanyl-5-methoxy-phenyl)ethyl]-1-methyl-3-methylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,2R)-2-[2-(2-bromanyl-5-methoxy-phenyl)ethyl]-1-methyl-3-methylidene-cyclohexane-1-carboxylate Openeye Name: methyl (1R,2R)-2-[2-(2-bromo-5-methoxy-phenyl)ethyl]-1-methyl-3-methylene-cyclohexanecarboxylate CAS Name: (1R,2R)-2-[2-(2-bromo-5-methoxyphenyl)ethyl]-1-methyl-3-methylene-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2R)-2-[2-(2-bromo-5-methoxyphenyl)ethyl]-1-methyl-3-methylidenecyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-[2-(2-bromo-5-methoxy-phenyl)ethyl]-1-methyl-3-methylene-cyclohexanecarboxylic acid methyl ester Formula: C19H25BrO3 MolecularWeight: 381.304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(=C)C1CCC2=C(C=CC(=C2)OC)Br)C(=O)OC

Isomeric SMILES

C[C@]1(CCCC(=C)[C@H]1CCC2=C(C=CC(=C2)OC)Br)C(=O)OC

InChI

InChI=1S/C19H25BrO3/c1-13-6-5-11-19(2,18(21)23-4)16(13)9-7-14-12-15(22-3)8-10-17(14)20/h8,10,12,16H,1,5-7,9,11H2,2-4H3/t16-,19-/m1/s1