(Z)-5-[4-(1-adamantyl)-3-methoxy-phenyl]-2-(3-bromophenyl)pent-2-en-1-ol

Systemtic Name: (Z)-5-[4-(1-adamantyl)-3-methoxy-phenyl]-2-(3-bromophenyl)pent-2-en-1-ol Openeye Name: (Z)-5-[4-(1-adamantyl)-3-methoxy-phenyl]-2-(3-bromophenyl)pent-2-en-1-ol CAS Name: (Z)-5-[4-(1-adamantyl)-3-methoxyphenyl]-2-(3-bromophenyl)-2-penten-1-ol IUPAC Name: (Z)-5-[4-(1-adamantyl)-3-methoxyphenyl]-2-(3-bromophenyl)pent-2-en-1-ol Traditional Name: (Z)-5-[4-(1-adamantyl)-3-methoxy-phenyl]-2-(3-bromophenyl)pent-2-en-1-ol Formula: C28H33BrO2 MolecularWeight: 481.46442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCC=C(CO)C2=CC(=CC=C2)Br)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=C(C=CC(=C1)CC/C=C(\CO)/C2=CC(=CC=C2)Br)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H33BrO2/c1-31-27-13-19(4-2-6-24(18-30)23-5-3-7-25(29)14-23)8-9-26(27)28-15-20-10-21(16-28)12-22(11-20)17-28/h3,5-9,13-14,20-22,30H,2,4,10-12,15-18H2,1H3/b24-6+