[2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]-2-oxidanylidene-ethyl] 4-cyanobenzoate

Systemtic Name: [2-[ethyl-[(3-fluoranyl-4-methoxy-phenyl)methyl]amino]-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-[ethyl-[(3-fluoro-4-methoxy-phenyl)methyl]amino]-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-[ethyl-(3-fluoro-4-methoxy-benzyl)amino]-2-keto-ethyl] ester Formula: C20H19FN2O4 MolecularWeight: 370.374263

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)COC(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)F)C(=O)COC(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H19FN2O4/c1-3-23(12-15-6-9-18(26-2)17(21)10-15)19(24)13-27-20(25)16-7-4-14(11-22)5-8-16/h4-10H,3,12-13H2,1-2H3