methyl 4-[3-(1,3-benzoxazol-6-yl)-1-fluoranyl-2-oxidanylidene-3-phenylazanyl-1-pyrrolidin-1-yl-propoxy]benzoate

Systemtic Name: methyl 4-[3-(1,3-benzoxazol-6-yl)-1-fluoranyl-2-oxidanylidene-3-phenylazanyl-1-pyrrolidin-1-yl-propoxy]benzoate Openeye Name: methyl 4-[3-anilino-3-(1,3-benzoxazol-6-yl)-1-fluoro-2-oxo-1-pyrrolidin-1-yl-propoxy]benzoate CAS Name: 4-[3-anilino-3-(1,3-benzoxazol-6-yl)-1-fluoro-2-oxo-1-(1-pyrrolidinyl)propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-anilino-3-(1,3-benzoxazol-6-yl)-1-fluoro-2-oxo-1-pyrrolidin-1-ylpropoxy]benzoate Traditional Name: 4-[3-anilino-3-(1,3-benzoxazol-6-yl)-1-fluoro-2-keto-1-pyrrolidino-propoxy]benzoic acid methyl ester Formula: C28H26FN3O5 MolecularWeight: 503.521543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC(C(=O)C(C2=CC3=C(C=C2)N=CO3)NC4=CC=CC=C4)(N5CCCC5)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC(C(=O)C(C2=CC3=C(C=C2)N=CO3)NC4=CC=CC=C4)(N5CCCC5)F

InChI

InChI=1S/C28H26FN3O5/c1-35-27(34)19-9-12-22(13-10-19)37-28(29,32-15-5-6-16-32)26(33)25(31-21-7-3-2-4-8-21)20-11-14-23-24(17-20)36-18-30-23/h2-4,7-14,17-18,25,31H,5-6,15-16H2,1H3