(3S,4R,5S,7R)-8-(5-bromanyl-2-methoxy-3-phenylmethoxy-phenyl)-5-methoxy-3,7-dimethyl-oct-1-en-4-ol

Systemtic Name: (3S,4R,5S,7R)-8-(5-bromanyl-2-methoxy-3-phenylmethoxy-phenyl)-5-methoxy-3,7-dimethyl-oct-1-en-4-ol Openeye Name: (3S,4R,5S,7R)-8-(3-benzyloxy-5-bromo-2-methoxy-phenyl)-5-methoxy-3,7-dimethyl-oct-1-en-4-ol CAS Name: (3S,4R,5S,7R)-8-(5-bromo-2-methoxy-3-phenylmethoxyphenyl)-5-methoxy-3,7-dimethyl-1-octen-4-ol IUPAC Name: (3S,4R,5S,7R)-8-(5-bromo-2-methoxy-3-phenylmethoxyphenyl)-5-methoxy-3,7-dimethyloct-1-en-4-ol Traditional Name: (3S,4R,5S,7R)-8-(3-benzoxy-5-bromo-2-methoxy-phenyl)-5-methoxy-3,7-dimethyl-oct-1-en-4-ol Formula: C25H33BrO4 MolecularWeight: 477.43112

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC(=C1OC)OCC2=CC=CC=C2)Br)CC(C(C(C)C=C)O)OC

Isomeric SMILES

C[C@H](CC1=CC(=CC(=C1OC)OCC2=CC=CC=C2)Br)C[C@@H]([C@@H]([C@@H](C)C=C)O)OC

InChI

InChI=1S/C25H33BrO4/c1-6-18(3)24(27)22(28-4)13-17(2)12-20-14-21(26)15-23(25(20)29-5)30-16-19-10-8-7-9-11-19/h6-11,14-15,17-18,22,24,27H,1,12-13,16H2,2-5H3/t17-,18+,22+,24-/m1/s1