propan-2-yl 3-(2-nitrophenyl)-3-[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-nitrophenyl)-3-[3-(2-oxidanylidene-1,3-thiazolidin-3-yl)propanoylamino]propanoate Openeye Name: isopropyl 3-(2-nitrophenyl)-3-[3-(2-oxothiazolidin-3-yl)propanoylamino]propanoate CAS Name: 3-(2-nitrophenyl)-3-[[1-oxo-3-(2-oxo-3-thiazolidinyl)propyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-nitrophenyl)-3-[3-(2-oxo-1,3-thiazolidin-3-yl)propanoylamino]propanoate Traditional Name: 3-[3-(2-ketothiazolidin-3-yl)propanoylamino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C18H23N3O6S MolecularWeight: 409.45672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCN2CCSC2=O

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCN2CCSC2=O

InChI

InChI=1S/C18H23N3O6S/c1-12(2)27-17(23)11-14(13-5-3-4-6-15(13)21(25)26)19-16(22)7-8-20-9-10-28-18(20)24/h3-6,12,14H,7-11H2,1-2H3,(H,19,22)