dimethyl (4S)-4-(2,4-dinitrophenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl (4S)-4-(2,4-dinitrophenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl (4S)-4-(2,4-dinitrophenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4S)-4-(2,4-dinitrophenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4S)-4-(2,4-dinitrophenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4S)-4-(2,4-dinitrophenyl)-2,6-dimethyl-3,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C17H17N3O8 MolecularWeight: 391.33218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OC)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)OC)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C17H17N3O8/c1-8-13(16(21)27-3)15(14(9(2)18-8)17(22)28-4)11-6-5-10(19(23)24)7-12(11)20(25)26/h5-7,13,15H,1-4H3/t13?,15-/m1/s1