(E)-2-[2,4-bis(bromanyl)phenoxy]-4,4-dimethyl-1-pyridin-3-yl-oct-1-en-3-ol

Systemtic Name: (E)-2-[2,4-bis(bromanyl)phenoxy]-4,4-dimethyl-1-pyridin-3-yl-oct-1-en-3-ol Openeye Name: (E)-2-(2,4-dibromophenoxy)-4,4-dimethyl-1-(3-pyridyl)oct-1-en-3-ol CAS Name: (E)-2-(2,4-dibromophenoxy)-4,4-dimethyl-1-(3-pyridinyl)-1-octen-3-ol IUPAC Name: (E)-2-(2,4-dibromophenoxy)-4,4-dimethyl-1-pyridin-3-yloct-1-en-3-ol Traditional Name: (E)-2-(2,4-dibromophenoxy)-4,4-dimethyl-1-(3-pyridyl)oct-1-en-3-ol Formula: C21H25Br2NO2 MolecularWeight: 483.2367

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C)C(C(=CC1=CN=CC=C1)OC2=C(C=C(C=C2)Br)Br)O

Isomeric SMILES

CCCCC(C)(C)C(/C(=C\C1=CN=CC=C1)/OC2=C(C=C(C=C2)Br)Br)O

InChI

InChI=1S/C21H25Br2NO2/c1-4-5-10-21(2,3)20(25)19(12-15-7-6-11-24-14-15)26-18-9-8-16(22)13-17(18)23/h6-9,11-14,20,25H,4-5,10H2,1-3H3/b19-12+