2-ethyl-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid

Systemtic Name: 2-ethyl-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid Openeye Name: 2-ethyl-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid CAS Name: 2-ethyl-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid IUPAC Name: 2-ethyl-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid Traditional Name: 2-ethyl-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid Formula: C17H18N2O6 MolecularWeight: 346.33462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=C(N1C)C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCC1=C(C(C(=C(N1C)C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H18N2O6/c1-4-12-15(17(22)23)14(13(16(20)21)9(2)18(12)3)10-6-5-7-11(8-10)19(24)25/h5-8,14H,4H2,1-3H3,(H,20,21)(H,22,23)