8-(3-nitrophenoxy)octyl pyridine-3-carboxylate

Systemtic Name: 8-(3-nitrophenoxy)octyl pyridine-3-carboxylate Openeye Name: 8-(3-nitrophenoxy)octyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid 8-(3-nitrophenoxy)octyl ester IUPAC Name: 8-(3-nitrophenoxy)octyl pyridine-3-carboxylate Traditional Name: nicotinic acid 8-(3-nitrophenoxy)octyl ester Formula: C20H24N2O5 MolecularWeight: 372.41496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCCCCCCOC(=O)C2=CN=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OCCCCCCCCOC(=O)C2=CN=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H24N2O5/c23-20(17-9-8-12-21-16-17)27-14-6-4-2-1-3-5-13-26-19-11-7-10-18(15-19)22(24)25/h7-12,15-16H,1-6,13-14H2