4,6-dimethyl-1-[(4-nitrophenyl)methyl]-2-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 4,6-dimethyl-1-[(4-nitrophenyl)methyl]-2-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 4,6-dimethyl-1-[(4-nitrophenyl)methyl]-2-oxo-pyridine-3-carboxylic acid CAS Name: 4,6-dimethyl-1-[(4-nitrophenyl)methyl]-2-oxo-3-pyridinecarboxylic acid IUPAC Name: 4,6-dimethyl-1-[(4-nitrophenyl)methyl]-2-oxopyridine-3-carboxylic acid Traditional Name: 2-keto-4,6-dimethyl-1-(4-nitrobenzyl)nicotinic acid Formula: C15H14N2O5 MolecularWeight: 302.28206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O)C

InChI

InChI=1S/C15H14N2O5/c1-9-7-10(2)16(14(18)13(9)15(19)20)8-11-3-5-12(6-4-11)17(21)22/h3-7H,8H2,1-2H3,(H,19,20)