(phenylmethyl) 3-fluoranyl-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-pyrrolidin-1-yl]benzoate

Systemtic Name: (phenylmethyl) 3-fluoranyl-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanylidene-pyrrolidin-1-yl]benzoate Openeye Name: benzyl 4-[3-(tert-butoxycarbonylamino)-2-oxo-pyrrolidin-1-yl]-3-fluoro-benzoate CAS Name: 3-fluoro-4-[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-oxo-1-pyrrolidinyl]benzoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-fluoro-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxopyrrolidin-1-yl]benzoate Traditional Name: 4-[3-(tert-butoxycarbonylamino)-2-keto-pyrrolidino]-3-fluoro-benzoic acid benzyl ester Formula: C23H25FN2O5 MolecularWeight: 428.453403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CCN(C1=O)C2=C(C=C(C=C2)C(=O)OCC3=CC=CC=C3)F

Isomeric SMILES

CC(C)(C)OC(=O)NC1CCN(C1=O)C2=C(C=C(C=C2)C(=O)OCC3=CC=CC=C3)F

InChI

InChI=1S/C23H25FN2O5/c1-23(2,3)31-22(29)25-18-11-12-26(20(18)27)19-10-9-16(13-17(19)24)21(28)30-14-15-7-5-4-6-8-15/h4-10,13,18H,11-12,14H2,1-3H3,(H,25,29)