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

Systemtic Name: 1-butyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid Openeye Name: 1-butyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid CAS Name: 1-butyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid IUPAC Name: 1-butyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid Traditional Name: 1-butyl-2,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid Formula: C19H22N2O6 MolecularWeight: 374.38778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(C(=C1C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C

Isomeric SMILES

CCCCN1C(=C(C(C(=C1C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C

InChI

InChI=1S/C19H22N2O6/c1-4-5-9-20-11(2)15(18(22)23)17(16(12(20)3)19(24)25)13-7-6-8-14(10-13)21(26)27/h6-8,10,17H,4-5,9H2,1-3H3,(H,22,23)(H,24,25)