3-bromanylpropyl 1-(3-nitrophenyl)-4H-pyridine-3-carboxylate

Systemtic Name: 3-bromanylpropyl 1-(3-nitrophenyl)-4H-pyridine-3-carboxylate Openeye Name: 3-bromopropyl 1-(3-nitrophenyl)-4H-pyridine-3-carboxylate CAS Name: 1-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid 3-bromopropyl ester IUPAC Name: 3-bromopropyl 1-(3-nitrophenyl)-4H-pyridine-3-carboxylate Traditional Name: 1-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid 3-bromopropyl ester Formula: C15H15BrN2O4 MolecularWeight: 367.1946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15BrN2O4/c16-7-3-9-22-15(19)12-4-2-8-17(11-12)13-5-1-6-14(10-13)18(20)21/h1-2,5-6,8,10-11H,3-4,7,9H2