[3-(octylcarbamoyloxy)phenyl] 2,2,2-tris(chloranyl)ethanoate

Systemtic Name: [3-(octylcarbamoyloxy)phenyl] 2,2,2-tris(chloranyl)ethanoate Openeye Name: [3-(octylcarbamoyloxy)phenyl] 2,2,2-trichloroacetate CAS Name: 2,2,2-trichloroacetic acid [3-[(octylamino)-oxomethoxy]phenyl] ester IUPAC Name: [3-(octylcarbamoyloxy)phenyl] 2,2,2-trichloroacetate Traditional Name: 2,2,2-trichloroacetic acid [3-(octylcarbamoyloxy)phenyl] ester Formula: C17H22Cl3NO4 MolecularWeight: 410.71988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)OC1=CC=CC(=C1)OC(=O)C(Cl)(Cl)Cl

Isomeric SMILES

CCCCCCCCNC(=O)OC1=CC=CC(=C1)OC(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C17H22Cl3NO4/c1-2-3-4-5-6-7-11-21-16(23)25-14-10-8-9-13(12-14)24-15(22)17(18,19)20/h8-10,12H,2-7,11H2,1H3,(H,21,23)