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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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