5-methyl-3-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]-4-(3-oxidanylpropyl)cycloheptan-1-ol

Systemtic Name: 5-methyl-3-[4-(2-methyloctan-2-yl)-2-phenylmethoxy-phenyl]-4-(3-oxidanylpropyl)cycloheptan-1-ol Openeye Name: 3-[2-benzyloxy-4-(1,1-dimethylheptyl)phenyl]-4-(3-hydroxypropyl)-5-methyl-cycloheptanol CAS Name: 4-(3-hydroxypropyl)-5-methyl-3-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]-1-cycloheptanol IUPAC Name: 4-(3-hydroxypropyl)-5-methyl-3-[4-(2-methyloctan-2-yl)-2-phenylmethoxyphenyl]cycloheptan-1-ol Traditional Name: 3-[2-benzoxy-4-(1,1-dimethylheptyl)phenyl]-4-(3-hydroxypropyl)-5-methyl-cycloheptanol Formula: C33H50O3 MolecularWeight: 494.7483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCC(C2CCCO)C)O)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCC(C)(C)C1=CC(=C(C=C1)C2CC(CCC(C2CCCO)C)O)OCC3=CC=CC=C3

InChI

InChI=1S/C33H50O3/c1-5-6-7-11-20-33(3,4)27-17-19-30(32(22-27)36-24-26-13-9-8-10-14-26)31-23-28(35)18-16-25(2)29(31)15-12-21-34/h8-10,13-14,17,19,22,25,28-29,31,34-35H,5-7,11-12,15-16,18,20-21,23-24H2,1-4H3