[2-[butyl(ethyl)amino]-6-chloranyl-phenyl]methylazanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=C(C(=CC=C1)Cl)C[NH3+]

Isomeric SMILES

CCCCN(CC)C1=C(C(=CC=C1)Cl)C[NH3+]

InChI

InChI=1S/C13H21ClN2/c1-3-5-9-16(4-2)13-8-6-7-12(14)11(13)10-15/h6-8H,3-5,9-10,15H2,1-2H3/p+1