ethyl (2R,4S)-6-methyl-4-(2-nitrophenyl)-2-(3-nitrophenyl)-3-nitroso-2,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (2R,4S)-6-methyl-4-(2-nitrophenyl)-2-(3-nitrophenyl)-3-nitroso-2,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (2R,4S)-6-methyl-4-(2-nitrophenyl)-2-(3-nitrophenyl)-3-nitroso-2,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (2R,4S)-6-methyl-4-(2-nitrophenyl)-2-(3-nitrophenyl)-3-nitroso-2,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (2R,4S)-6-methyl-4-(2-nitrophenyl)-2-(3-nitrophenyl)-3-nitroso-2,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (2R,4S)-6-methyl-4-(2-nitrophenyl)-2-(3-nitrophenyl)-3-nitroso-2,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H19N5O7 MolecularWeight: 441.39416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(N(C1C2=CC=CC=C2[N+](=O)[O-])N=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N[C@H](N([C@H]1C2=CC=CC=C2[N+](=O)[O-])N=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H19N5O7/c1-3-32-20(26)17-12(2)21-19(13-7-6-8-14(11-13)24(28)29)23(22-27)18(17)15-9-4-5-10-16(15)25(30)31/h4-11,18-19,21H,3H2,1-2H3/t18-,19+/m0/s1