3,3-bis[8,9-bis(chloranyl)undecan-5-yl]-4,5,6-trimethyl-dodecan-2-one

Systemtic Name: 3,3-bis[8,9-bis(chloranyl)undecan-5-yl]-4,5,6-trimethyl-dodecan-2-one Openeye Name: 3,3-bis(1-butyl-4,5-dichloro-heptyl)-4,5,6-trimethyl-dodecan-2-one CAS Name: 3,3-bis(8,9-dichloroundecan-5-yl)-4,5,6-trimethyl-2-dodecanone IUPAC Name: 3,3-bis(8,9-dichloroundecan-5-yl)-4,5,6-trimethyldodecan-2-one Traditional Name: 3,3-bis(1-butyl-4,5-dichloro-heptyl)-4,5,6-trimethyl-dodecan-2-one Formula: C37H70Cl4O MolecularWeight: 672.7631

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)C(C)C(C)C(C(CCCC)CCC(C(CC)Cl)Cl)(C(CCCC)CCC(C(CC)Cl)Cl)C(=O)C

Isomeric SMILES

CCCCCCC(C)C(C)C(C)C(C(CCCC)CCC(C(CC)Cl)Cl)(C(CCCC)CCC(C(CC)Cl)Cl)C(=O)C

InChI

InChI=1S/C37H70Cl4O/c1-10-15-18-19-20-27(6)28(7)29(8)37(30(9)42,31(21-16-11-2)23-25-35(40)33(38)13-4)32(22-17-12-3)24-26-36(41)34(39)14-5/h27-29,31-36H,10-26H2,1-9H3