[2-ethyl-6-methyl-3-oxidanyl-5-[2,2,2-tris(chloranyl)ethoxycarbonylamino]oxan-4-yl] benzoate

Systemtic Name: [2-ethyl-6-methyl-3-oxidanyl-5-[2,2,2-tris(chloranyl)ethoxycarbonylamino]oxan-4-yl] benzoate Openeye Name: [2-ethyl-3-hydroxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)tetrahydropyran-4-yl] benzoate CAS Name: benzoic acid [2-ethyl-3-hydroxy-6-methyl-5-[[oxo(2,2,2-trichloroethoxy)methyl]amino]-4-oxanyl] ester IUPAC Name: [2-ethyl-3-hydroxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)oxan-4-yl] benzoate Traditional Name: benzoic acid [2-ethyl-3-hydroxy-6-methyl-5-(2,2,2-trichloroethoxycarbonylamino)tetrahydropyran-4-yl] ester Formula: C18H22Cl3NO6 MolecularWeight: 454.72938

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(C(C(O1)C)NC(=O)OCC(Cl)(Cl)Cl)OC(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCC1C(C(C(C(O1)C)NC(=O)OCC(Cl)(Cl)Cl)OC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C18H22Cl3NO6/c1-3-12-14(23)15(28-16(24)11-7-5-4-6-8-11)13(10(2)27-12)22-17(25)26-9-18(19,20)21/h4-8,10,12-15,23H,3,9H2,1-2H3,(H,22,25)