O3-(2-nitrooxyethyl) O5-propan-2-yl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-(2-nitrooxyethyl) O5-propan-2-yl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-isopropyl O3-(2-nitrooxyethyl) 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-(2-nitrooxyethyl) ester O5-propan-2-yl ester IUPAC Name: 3-O-(2-nitrooxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-isopropyl ester O3-(2-nitrooxyethyl) ester Formula: C20H23N3O9 MolecularWeight: 449.41132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O9/c1-11(2)32-20(25)17-13(4)21-12(3)16(19(24)30-9-10-31-23(28)29)18(17)14-7-5-6-8-15(14)22(26)27/h5-8,11,18,21H,9-10H2,1-4H3