[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-(3-fluoranyl-4-methoxy-phenyl)ethanoate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-(3-fluoranyl-4-methoxy-phenyl)ethanoate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-(3-fluoro-4-methoxy-phenyl)acetate CAS Name: 2-(3-fluoro-4-methoxyphenyl)acetic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-(3-fluoro-4-methoxyphenyl)acetate Traditional Name: 2-(3-fluoro-4-methoxy-phenyl)acetic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C14H15FN2O4 MolecularWeight: 294.278303

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)OCC(=O)NCCC#N)F

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)OCC(=O)NCCC#N)F

InChI

InChI=1S/C14H15FN2O4/c1-20-12-4-3-10(7-11(12)15)8-14(19)21-9-13(18)17-6-2-5-16/h3-4,7H,2,6,8-9H2,1H3,(H,17,18)