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

Systemtic Name: propan-2-yl 3-[[4-(dimethylamino)-3-nitro-phenyl]carbonylamino]-3-(2-nitrophenyl)propanoate Openeye Name: isopropyl 3-[[4-(dimethylamino)-3-nitro-benzoyl]amino]-3-(2-nitrophenyl)propanoate CAS Name: 3-[[[4-(dimethylamino)-3-nitrophenyl]-oxomethyl]amino]-3-(2-nitrophenyl)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[4-(dimethylamino)-3-nitrobenzoyl]amino]-3-(2-nitrophenyl)propanoate Traditional Name: 3-[[4-(dimethylamino)-3-nitro-benzoyl]amino]-3-(2-nitrophenyl)propionic acid isopropyl ester Formula: C21H24N4O7 MolecularWeight: 444.43786

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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)N(C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O7/c1-13(2)32-20(26)12-16(15-7-5-6-8-17(15)24(28)29)22-21(27)14-9-10-18(23(3)4)19(11-14)25(30)31/h5-11,13,16H,12H2,1-4H3,(H,22,27)