[2-[2-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3,4,5-trimethoxybenzoate

Systemtic Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3,4,5-trimethoxybenzoate Openeye Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxo-ethyl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [2-[2-(4-fluorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C20H22FNO6 MolecularWeight: 391.390183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)NCCC2=CC=C(C=C2)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)NCCC2=CC=C(C=C2)F

InChI

InChI=1S/C20H22FNO6/c1-25-16-10-14(11-17(26-2)19(16)27-3)20(24)28-12-18(23)22-9-8-13-4-6-15(21)7-5-13/h4-7,10-11H,8-9,12H2,1-3H3,(H,22,23)