propan-2-yl 3-(2-nitrophenyl)-3-[3-(thiophen-3-ylcarbonylamino)propanoylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-nitrophenyl)-3-[3-(thiophen-3-ylcarbonylamino)propanoylamino]propanoate Openeye Name: isopropyl 3-(2-nitrophenyl)-3-[3-(thiophene-3-carbonylamino)propanoylamino]propanoate CAS Name: 3-(2-nitrophenyl)-3-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-nitrophenyl)-3-[3-(thiophene-3-carbonylamino)propanoylamino]propanoate Traditional Name: 3-(2-nitrophenyl)-3-[3-(3-thenoylamino)propanoylamino]propionic acid isopropyl ester Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCNC(=O)C2=CSC=C2

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1[N+](=O)[O-])NC(=O)CCNC(=O)C2=CSC=C2

InChI

InChI=1S/C20H23N3O6S/c1-13(2)29-19(25)11-16(15-5-3-4-6-17(15)23(27)28)22-18(24)7-9-21-20(26)14-8-10-30-12-14/h3-6,8,10,12-13,16H,7,9,11H2,1-2H3,(H,21,26)(H,22,24)