12-[2,5-bis(bromanyl)-4-butoxy-phenoxy]dodecan-2-one

Systemtic Name: 12-[2,5-bis(bromanyl)-4-butoxy-phenoxy]dodecan-2-one Openeye Name: 12-(2,5-dibromo-4-butoxy-phenoxy)dodecan-2-one CAS Name: 12-(2,5-dibromo-4-butoxyphenoxy)-2-dodecanone IUPAC Name: 12-(2,5-dibromo-4-butoxyphenoxy)dodecan-2-one Traditional Name: 12-(2,5-dibromo-4-butoxy-phenoxy)dodecan-2-one Formula: C22H34Br2O3 MolecularWeight: 506.31156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC(=C(C=C1Br)OCCCCCCCCCCC(=O)C)Br

Isomeric SMILES

CCCCOC1=CC(=C(C=C1Br)OCCCCCCCCCCC(=O)C)Br

InChI

InChI=1S/C22H34Br2O3/c1-3-4-14-26-21-16-20(24)22(17-19(21)23)27-15-12-10-8-6-5-7-9-11-13-18(2)25/h16-17H,3-15H2,1-2H3