propan-2-yl 3-[2-[(2-fluorophenyl)carbonylamino]ethanoylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[2-[(2-fluorophenyl)carbonylamino]ethanoylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[[2-[(2-fluorobenzoyl)amino]acetyl]amino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[2-[[(2-fluorophenyl)-oxomethyl]amino]-1-oxoethyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[2-[(2-fluorobenzoyl)amino]acetyl]amino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[[2-[(2-fluorobenzoyl)amino]acetyl]amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C21H22FN3O6 MolecularWeight: 431.414283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CNC(=O)C2=CC=CC=C2F

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CNC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C21H22FN3O6/c1-13(2)31-20(27)11-17(15-8-4-6-10-18(15)25(29)30)24-19(26)12-23-21(28)14-7-3-5-9-16(14)22/h3-10,13,17H,11-12H2,1-2H3,(H,23,28)(H,24,26)