[2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] 3-(ethoxymethyl)-4-methoxy-benzoate

Systemtic Name: [2-(4-acetamido-2-fluoranyl-phenyl)-2-oxidanylidene-ethyl] 3-(ethoxymethyl)-4-methoxy-benzoate Openeye Name: [2-(4-acetamido-2-fluoro-phenyl)-2-oxo-ethyl] 3-(ethoxymethyl)-4-methoxy-benzoate CAS Name: 3-(ethoxymethyl)-4-methoxybenzoic acid [2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamido-2-fluorophenyl)-2-oxoethyl] 3-(ethoxymethyl)-4-methoxybenzoate Traditional Name: 3-(ethoxymethyl)-4-methoxy-benzoic acid [2-(4-acetamido-2-fluoro-phenyl)-2-keto-ethyl] ester Formula: C21H22FNO6 MolecularWeight: 403.400883

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(C=CC(=C1)C(=O)OCC(=O)C2=C(C=C(C=C2)NC(=O)C)F)OC

Isomeric SMILES

CCOCC1=C(C=CC(=C1)C(=O)OCC(=O)C2=C(C=C(C=C2)NC(=O)C)F)OC

InChI

InChI=1S/C21H22FNO6/c1-4-28-11-15-9-14(5-8-20(15)27-3)21(26)29-12-19(25)17-7-6-16(10-18(17)22)23-13(2)24/h5-10H,4,11-12H2,1-3H3,(H,23,24)