1-methyl-3-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]cyclohex-2-en-1-ol

Systemtic Name: 1-methyl-3-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]cyclohex-2-en-1-ol Openeye Name: 3-[2-benzyloxy-4-(1,1-dimethylheptyl)phenyl]-1-methyl-cyclohex-2-en-1-ol CAS Name: 1-methyl-3-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]-1-cyclohex-2-enol IUPAC Name: 1-methyl-3-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]cyclohex-2-en-1-ol Traditional Name: 3-[2-benzoxy-4-(1,1-dimethylheptyl)phenyl]-1-methyl-cyclohex-2-en-1-ol Formula: C29H40O2 MolecularWeight: 420.6267

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2=CC(CCC2)(C)O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2=CC(CCC2)(C)O)OCC3=CC=CC=C3

InChI

InChI=1S/C29H40O2/c1-5-6-7-11-18-28(2,3)25-16-17-26(24-15-12-19-29(4,30)21-24)27(20-25)31-22-23-13-9-8-10-14-23/h8-10,13-14,16-17,20-21,30H,5-7,11-12,15,18-19,22H2,1-4H3