methyl (4S)-3-(4,6-dimethoxy-5-nitro-pyrimidin-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-5-carboxylate

Systemtic Name: methyl (4S)-3-(4,6-dimethoxy-5-nitro-pyrimidin-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-5-carboxylate Openeye Name: methyl (4S)-3-(4,6-dimethoxy-5-nitro-pyrimidin-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-5-carboxylate CAS Name: (4S)-3-(4,6-dimethoxy-5-nitro-2-pyrimidinyl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-3-(4,6-dimethoxy-5-nitropyrimidin-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-5-carboxylate Traditional Name: (4S)-3-(4,6-dimethoxy-5-nitro-pyrimidin-2-yl)-2,6-dimethyl-4-(3-nitrophenyl)-3,4-dihydropyridine-5-carboxylic acid methyl ester Formula: C21H21N5O8 MolecularWeight: 471.42014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C2=NC(=C(C(=N2)OC)[N+](=O)[O-])OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC)C

Isomeric SMILES

CC1=NC(=C([C@@H](C1C2=NC(=C(C(=N2)OC)[N+](=O)[O-])OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC)C

InChI

InChI=1S/C21H21N5O8/c1-10-14(18-23-19(32-3)17(26(30)31)20(24-18)33-4)16(15(11(2)22-10)21(27)34-5)12-7-6-8-13(9-12)25(28)29/h6-9,14,16H,1-5H3/t14?,16-/m1/s1