methyl (1R,2R)-2-[2-(2-bromanyl-4-methoxy-phenyl)ethyl]-1-methyl-3-methylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,2R)-2-[2-(2-bromanyl-4-methoxy-phenyl)ethyl]-1-methyl-3-methylidene-cyclohexane-1-carboxylate Openeye Name: methyl (1R,2R)-2-[2-(2-bromo-4-methoxy-phenyl)ethyl]-1-methyl-3-methylene-cyclohexanecarboxylate CAS Name: (1R,2R)-2-[2-(2-bromo-4-methoxyphenyl)ethyl]-1-methyl-3-methylene-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2R)-2-[2-(2-bromo-4-methoxyphenyl)ethyl]-1-methyl-3-methylidenecyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-[2-(2-bromo-4-methoxy-phenyl)ethyl]-1-methyl-3-methylene-cyclohexanecarboxylic acid methyl ester Formula: C19H25BrO3 MolecularWeight: 381.304

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25BrO3/c1-13-6-5-11-19(2,18(21)23-4)16(13)10-8-14-7-9-15(22-3)12-17(14)20/h7,9,12,16H,1,5-6,8,10-11H2,2-4H3/t16-,19-/m1/s1