methyl (2R,4S)-6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Systemtic Name: methyl (2R,4S)-6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate Openeye Name: methyl (2R,4S)-6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate CAS Name: (2R,4S)-6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (2R,4S)-6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylate Traditional Name: (2R,4S)-6-methyl-2,4-bis(4-nitrophenyl)-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid methyl ester Formula: C19H18N4O6 MolecularWeight: 398.36942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(N1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C([C@@H](N[C@H](N1)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C19H18N4O6/c1-11-16(19(24)29-2)17(12-3-7-14(8-4-12)22(25)26)21-18(20-11)13-5-9-15(10-6-13)23(27)28/h3-10,17-18,20-21H,1-2H3/t17-,18-/m0/s1