methyl (1R,2R)-2-[(2-bromophenyl)methyl]-1-methyl-3-methylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,2R)-2-[(2-bromophenyl)methyl]-1-methyl-3-methylidene-cyclohexane-1-carboxylate Openeye Name: methyl (1R,2R)-2-[(2-bromophenyl)methyl]-1-methyl-3-methylene-cyclohexanecarboxylate CAS Name: (1R,2R)-2-[(2-bromophenyl)methyl]-1-methyl-3-methylene-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2R)-2-[(2-bromophenyl)methyl]-1-methyl-3-methylidenecyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-(2-bromobenzyl)-1-methyl-3-methylene-cyclohexanecarboxylic acid methyl ester Formula: C17H21BrO2 MolecularWeight: 337.25144

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(=C)C1CC2=CC=CC=C2Br)C(=O)OC

Isomeric SMILES

C[C@]1(CCCC(=C)[C@H]1CC2=CC=CC=C2Br)C(=O)OC

InChI

InChI=1S/C17H21BrO2/c1-12-7-6-10-17(2,16(19)20-3)14(12)11-13-8-4-5-9-15(13)18/h4-5,8-9,14H,1,6-7,10-11H2,2-3H3/t14-,17-/m1/s1