[2-[2-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3-methoxy-4-prop-2-enoxy-benzoate

Systemtic Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3-methoxy-4-prop-2-enoxy-benzoate Openeye Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxo-ethyl] 4-allyloxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-prop-2-enoxybenzoic acid [2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl] 3-methoxy-4-prop-2-enoxybenzoate Traditional Name: 4-allyloxy-3-methoxy-benzoic acid [2-[2-(4-fluorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C21H22FNO5 MolecularWeight: 387.401483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OCC(=O)NCCC2=CC=C(C=C2)F)OCC=C

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OCC(=O)NCCC2=CC=C(C=C2)F)OCC=C

InChI

InChI=1S/C21H22FNO5/c1-3-12-27-18-9-6-16(13-19(18)26-2)21(25)28-14-20(24)23-11-10-15-4-7-17(22)8-5-15/h3-9,13H,1,10-12,14H2,2H3,(H,23,24)