1-(2-methoxyethyl)-2-methyl-5-nitro-4-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid

Systemtic Name: 1-(2-methoxyethyl)-2-methyl-5-nitro-4-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid Openeye Name: 1-(2-methoxyethyl)-2-methyl-5-nitro-4-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 1-(2-methoxyethyl)-2-methyl-5-nitro-4-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 1-(2-methoxyethyl)-2-methyl-5-nitro-4-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid Traditional Name: 1-(2-methoxyethyl)-2-methyl-5-nitro-4-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid Formula: C16H17N3O7 MolecularWeight: 363.32208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=CN1CCOC)[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(C(=CN1CCOC)[N+](=O)[O-])C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C16H17N3O7/c1-10-14(16(20)21)15(11-3-5-12(6-4-11)18(22)23)13(19(24)25)9-17(10)7-8-26-2/h3-6,9,15H,7-8H2,1-2H3,(H,20,21)