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

Systemtic Name: propan-2-yl 3-(2-chlorophenyl)-3-[2-[(3-nitrophenyl)carbonylamino]ethanoylamino]propanoate Openeye Name: isopropyl 3-(2-chlorophenyl)-3-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propanoate CAS Name: 3-(2-chlorophenyl)-3-[[2-[[(3-nitrophenyl)-oxomethyl]amino]-1-oxoethyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-chlorophenyl)-3-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propanoate Traditional Name: 3-(2-chlorophenyl)-3-[[2-[(3-nitrobenzoyl)amino]acetyl]amino]propionic acid isopropyl ester Formula: C21H22ClN3O6 MolecularWeight: 447.86888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C21H22ClN3O6/c1-13(2)31-20(27)11-18(16-8-3-4-9-17(16)22)24-19(26)12-23-21(28)14-6-5-7-15(10-14)25(29)30/h3-10,13,18H,11-12H2,1-2H3,(H,23,28)(H,24,26)