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

Systemtic Name: 5-methoxycarbonyl-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Openeye Name: 5-methoxycarbonyl-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: 5-methoxycarbonyl-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate IUPAC Name: 5-methoxycarbonyl-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Traditional Name: 5-carbomethoxy-1-(methoxymethyl)-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3-carboxylate Formula: C18H19N2O7- MolecularWeight: 375.35266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O7/c1-10-14(17(21)22)16(12-6-5-7-13(8-12)20(24)25)15(18(23)27-4)11(2)19(10)9-26-3/h5-8,16H,9H2,1-4H3,(H,21,22)/p-1