propan-2-yl 3-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[2-(2-chloro-6-fluorophenyl)-1-oxoethyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C20H20ClFN2O5 MolecularWeight: 422.834603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CC2=C(C=CC=C2Cl)F

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CC2=C(C=CC=C2Cl)F

InChI

InChI=1S/C20H20ClFN2O5/c1-12(2)29-20(26)11-17(13-6-3-4-9-18(13)24(27)28)23-19(25)10-14-15(21)7-5-8-16(14)22/h3-9,12,17H,10-11H2,1-2H3,(H,23,25)