[2-[[3,5-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate

Systemtic Name: [2-[[3,5-bis(fluoranyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate Openeye Name: [2-(3,5-difluoroanilino)-2-oxo-ethyl] 4-[(tert-butoxycarbonylamino)methyl]benzoate CAS Name: 4-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]benzoic acid [2-(3,5-difluoroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-difluoroanilino)-2-oxoethyl] 4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]benzoate Traditional Name: 4-[(tert-butoxycarbonylamino)methyl]benzoic acid [2-(3,5-difluoroanilino)-2-keto-ethyl] ester Formula: C21H22F2N2O5 MolecularWeight: 420.406586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC(=C2)F)F

Isomeric SMILES

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC(=CC(=C2)F)F

InChI

InChI=1S/C21H22F2N2O5/c1-21(2,3)30-20(28)24-11-13-4-6-14(7-5-13)19(27)29-12-18(26)25-17-9-15(22)8-16(23)10-17/h4-10H,11-12H2,1-3H3,(H,24,28)(H,25,26)