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

Systemtic Name: O3-(2-nitrooxyethyl) O5-propan-2-yl 2,6-dimethyl-4-(3-methylimidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O5-isopropyl O3-(2-nitrooxyethyl) 2,6-dimethyl-4-(3-methylimidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-methyl-4-imidazolyl)-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-(3-methylimidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-methylimidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-isopropyl ester O3-(2-nitrooxyethyl) ester Formula: C18H24N4O7 MolecularWeight: 408.40576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CN=CN2C)C(=O)OCCO[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC(C)C)C2=CN=CN2C)C(=O)OCCO[N+](=O)[O-]

InChI

InChI=1S/C18H24N4O7/c1-10(2)29-18(24)15-12(4)20-11(3)14(16(15)13-8-19-9-21(13)5)17(23)27-6-7-28-22(25)26/h8-10,16,20H,6-7H2,1-5H3