[2-[2-cyanoethyl-(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylbenzoate

Systemtic Name: [2-[2-cyanoethyl-(4-fluorophenyl)amino]-2-oxidanylidene-ethyl] 4-oxidanylbenzoate Openeye Name: [2-[N-(2-cyanoethyl)-4-fluoro-anilino]-2-oxo-ethyl] 4-hydroxybenzoate CAS Name: 4-hydroxybenzoic acid [2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl] ester IUPAC Name: [2-[N-(2-cyanoethyl)-4-fluoroanilino]-2-oxoethyl] 4-hydroxybenzoate Traditional Name: 4-hydroxybenzoic acid [2-[N-(2-cyanoethyl)-4-fluoro-anilino]-2-keto-ethyl] ester Formula: C18H15FN2O4 MolecularWeight: 342.321103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OCC(=O)N(CCC#N)C2=CC=C(C=C2)F)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)OCC(=O)N(CCC#N)C2=CC=C(C=C2)F)O

InChI

InChI=1S/C18H15FN2O4/c19-14-4-6-15(7-5-14)21(11-1-10-20)17(23)12-25-18(24)13-2-8-16(22)9-3-13/h2-9,22H,1,11-12H2