hexadecyl 3,4,4-tris(chloranyl)but-3-enoate

Systemtic Name: hexadecyl 3,4,4-tris(chloranyl)but-3-enoate Openeye Name: hexadecyl 3,4,4-trichlorobut-3-enoate CAS Name: 3,4,4-trichloro-3-butenoic acid hexadecyl ester IUPAC Name: hexadecyl 3,4,4-trichlorobut-3-enoate Traditional Name: 3,4,4-trichlorobut-3-enoic acid cetyl ester Formula: C20H35Cl3O2 MolecularWeight: 413.8497

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)CC(=C(Cl)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)CC(=C(Cl)Cl)Cl

InChI

InChI=1S/C20H35Cl3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-25-19(24)17-18(21)20(22)23/h2-17H2,1H3