propan-2-yl 3-[[4-(dimethylsulfamoyl)phenyl]carbonylamino]-3-(2-nitrophenyl)propanoate

Systemtic Name: propan-2-yl 3-[[4-(dimethylsulfamoyl)phenyl]carbonylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[[4-(dimethylsulfamoyl)benzoyl]amino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[[4-(dimethylsulfamoyl)phenyl]-oxomethyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[4-(dimethylsulfamoyl)benzoyl]amino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[[4-(dimethylsulfamoyl)benzoyl]amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C21H25N3O7S MolecularWeight: 463.5041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O7S/c1-14(2)31-20(25)13-18(17-7-5-6-8-19(17)24(27)28)22-21(26)15-9-11-16(12-10-15)32(29,30)23(3)4/h5-12,14,18H,13H2,1-4H3,(H,22,26)