(1S,2S)-2-[(2-bromanyl-5-methoxy-phenyl)methyl]-1-but-3-enyl-3,3-dimethyl-cyclohexan-1-ol

Systemtic Name: (1S,2S)-2-[(2-bromanyl-5-methoxy-phenyl)methyl]-1-but-3-enyl-3,3-dimethyl-cyclohexan-1-ol Openeye Name: (1S,2S)-2-[(2-bromo-5-methoxy-phenyl)methyl]-1-but-3-enyl-3,3-dimethyl-cyclohexanol CAS Name: (1S,2S)-2-[(2-bromo-5-methoxyphenyl)methyl]-1-but-3-enyl-3,3-dimethyl-1-cyclohexanol IUPAC Name: (1S,2S)-2-[(2-bromo-5-methoxyphenyl)methyl]-1-but-3-enyl-3,3-dimethylcyclohexan-1-ol Traditional Name: (1S,2S)-2-(2-bromo-5-methoxy-benzyl)-1-but-3-enyl-3,3-dimethyl-cyclohexanol Formula: C20H29BrO2 MolecularWeight: 381.34706

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC(C1CC2=C(C=CC(=C2)OC)Br)(CCC=C)O)C

Isomeric SMILES

CC1(CCC[C@@]([C@H]1CC2=C(C=CC(=C2)OC)Br)(CCC=C)O)C

InChI

InChI=1S/C20H29BrO2/c1-5-6-11-20(22)12-7-10-19(2,3)18(20)14-15-13-16(23-4)8-9-17(15)21/h5,8-9,13,18,22H,1,6-7,10-12,14H2,2-4H3/t18-,20+/m0/s1