[2-chloranyl-6-(dipropylamino)phenyl]methylazanium

Systemtic Name: [2-chloranyl-6-(dipropylamino)phenyl]methylazanium Openeye Name: [2-chloro-6-(dipropylamino)phenyl]methylammonium CAS Name: [2-chloro-6-(dipropylamino)phenyl]methylammonium IUPAC Name: [2-chloro-6-(dipropylamino)phenyl]methylazanium Traditional Name: [2-chloro-6-(dipropylamino)benzyl]ammonium Formula: C13H22ClN2+ MolecularWeight: 241.78018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C(=CC=C1)Cl)C[NH3+]

Isomeric SMILES

CCCN(CCC)C1=C(C(=CC=C1)Cl)C[NH3+]

InChI

InChI=1S/C13H21ClN2/c1-3-8-16(9-4-2)13-7-5-6-12(14)11(13)10-15/h5-7H,3-4,8-10,15H2,1-2H3/p+1