1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate IUPAC Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Formula: C17H16N2O7-2 MolecularWeight: 360.31814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1COC)C)C(=O)[O-])C2=CC(=CC=C2)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1COC)C)C(=O)[O-])C2=CC(=CC=C2)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C17H18N2O7/c1-9-13(16(20)21)15(11-5-4-6-12(7-11)19(24)25)14(17(22)23)10(2)18(9)8-26-3/h4-7,15H,8H2,1-3H3,(H,20,21)(H,22,23)/p-2