2,2-bis(bromanyl)-1-(5-ethenyl-2,4-dihexoxy-phenyl)adamantane

Systemtic Name: 2,2-bis(bromanyl)-1-(5-ethenyl-2,4-dihexoxy-phenyl)adamantane Openeye Name: 2,2-dibromo-1-(2,4-dihexoxy-5-vinyl-phenyl)adamantane CAS Name: 2,2-dibromo-1-(5-ethenyl-2,4-dihexoxyphenyl)adamantane IUPAC Name: 2,2-dibromo-1-(5-ethenyl-2,4-dihexoxyphenyl)adamantane Traditional Name: 2,2-dibromo-1-(2,4-dihexoxy-5-vinyl-phenyl)adamantane Formula: C30H44Br2O2 MolecularWeight: 596.47716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC(=C(C=C1C=C)C23CC4CC(C2)CC(C4)C3(Br)Br)OCCCCCC

Isomeric SMILES

CCCCCCOC1=CC(=C(C=C1C=C)C23CC4CC(C2)CC(C4)C3(Br)Br)OCCCCCC

InChI

InChI=1S/C30H44Br2O2/c1-4-7-9-11-13-33-27-19-28(34-14-12-10-8-5-2)26(18-24(27)6-3)29-20-22-15-23(21-29)17-25(16-22)30(29,31)32/h6,18-19,22-23,25H,3-5,7-17,20-21H2,1-2H3