2-butyl-4-chloranyl-1-oxidanidyl-quinolin-1-ium

Systemtic Name: 2-butyl-4-chloranyl-1-oxidanidyl-quinolin-1-ium Openeye Name: 2-butyl-4-chloro-1-oxido-quinolin-1-ium CAS Name: 2-butyl-4-chloro-1-oxidoquinolin-1-ium IUPAC Name: 2-butyl-4-chloro-1-oxidoquinolin-1-ium Traditional Name: 2-butyl-4-chloro-1-oxido-quinolin-1-ium Formula: C13H14ClNO MolecularWeight: 235.70936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[N+](C2=CC=CC=C2C(=C1)Cl)[O-]

Isomeric SMILES

CCCCC1=[N+](C2=CC=CC=C2C(=C1)Cl)[O-]

InChI

InChI=1S/C13H14ClNO/c1-2-3-6-10-9-12(14)11-7-4-5-8-13(11)15(10)16/h4-5,7-9H,2-3,6H2,1H3