2-diethylaminoethyl 2,5-bis[2,2,2-tris(fluoranyl)ethoxy]benzoate

Systemtic Name: 2-diethylaminoethyl 2,5-bis[2,2,2-tris(fluoranyl)ethoxy]benzoate Openeye Name: 2-diethylaminoethyl 2,5-bis(2,2,2-trifluoroethoxy)benzoate CAS Name: 2,5-bis(2,2,2-trifluoroethoxy)benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 2,5-bis(2,2,2-trifluoroethoxy)benzoate Traditional Name: 2,5-bis(2,2,2-trifluoroethoxy)benzoic acid 2-diethylaminoethyl ester Formula: C17H21F6NO4 MolecularWeight: 417.343359

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=C(C=CC(=C1)OCC(F)(F)F)OCC(F)(F)F

Isomeric SMILES

CCN(CC)CCOC(=O)C1=C(C=CC(=C1)OCC(F)(F)F)OCC(F)(F)F

InChI

InChI=1S/C17H21F6NO4/c1-3-24(4-2)7-8-26-15(25)13-9-12(27-10-16(18,19)20)5-6-14(13)28-11-17(21,22)23/h5-6,9H,3-4,7-8,10-11H2,1-2H3