methyl 4-[1-fluoranyl-2-oxidanylidene-3-[4-(phenylmethoxycarbonylamino)phenyl]-1-pyrrolidin-1-yl-propoxy]benzoate

Systemtic Name: methyl 4-[1-fluoranyl-2-oxidanylidene-3-[4-(phenylmethoxycarbonylamino)phenyl]-1-pyrrolidin-1-yl-propoxy]benzoate Openeye Name: methyl 4-[3-[4-(benzyloxycarbonylamino)phenyl]-1-fluoro-2-oxo-1-pyrrolidin-1-yl-propoxy]benzoate CAS Name: 4-[1-fluoro-2-oxo-3-[4-(phenylmethoxycarbonylamino)phenyl]-1-(1-pyrrolidinyl)propoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[1-fluoro-2-oxo-3-[4-(phenylmethoxycarbonylamino)phenyl]-1-pyrrolidin-1-ylpropoxy]benzoate Traditional Name: 4-[3-[4-(benzyloxycarbonylamino)phenyl]-1-fluoro-2-keto-1-pyrrolidino-propoxy]benzoic acid methyl ester Formula: C29H29FN2O6 MolecularWeight: 520.548763

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC(C(=O)CC2=CC=C(C=C2)NC(=O)OCC3=CC=CC=C3)(N4CCCC4)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC(C(=O)CC2=CC=C(C=C2)NC(=O)OCC3=CC=CC=C3)(N4CCCC4)F

InChI

InChI=1S/C29H29FN2O6/c1-36-27(34)23-11-15-25(16-12-23)38-29(30,32-17-5-6-18-32)26(33)19-21-9-13-24(14-10-21)31-28(35)37-20-22-7-3-2-4-8-22/h2-4,7-16H,5-6,17-20H2,1H3,(H,31,35)