2-hydroxyethyl 5-ethanoyl-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3-carboxylate

Systemtic Name: 2-hydroxyethyl 5-ethanoyl-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3-carboxylate Openeye Name: 2-hydroxyethyl 5-acetyl-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3-carboxylate CAS Name: 5-acetyl-2,6-dimethyl-4-(3-nitrophenyl)-3-pyridinecarboxylic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 5-acetyl-2,6-dimethyl-4-(3-nitrophenyl)pyridine-3-carboxylate Traditional Name: 5-acetyl-2,6-dimethyl-4-(3-nitrophenyl)nicotinic acid 2-hydroxyethyl ester Formula: C18H18N2O6 MolecularWeight: 358.34532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C)C(=O)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCO

Isomeric SMILES

CC1=C(C(=C(C(=N1)C)C(=O)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCCO

InChI

InChI=1S/C18H18N2O6/c1-10-15(12(3)22)17(13-5-4-6-14(9-13)20(24)25)16(11(2)19-10)18(23)26-8-7-21/h4-6,9,21H,7-8H2,1-3H3