(3-azanyl-4-chloranyl-phenyl)methyl-butyl-ethyl-azanium

Systemtic Name: (3-azanyl-4-chloranyl-phenyl)methyl-butyl-ethyl-azanium Openeye Name: (3-amino-4-chloro-phenyl)methyl-butyl-ethyl-ammonium CAS Name: (3-amino-4-chlorophenyl)methyl-butyl-ethylammonium IUPAC Name: (3-amino-4-chlorophenyl)methyl-butyl-ethylazanium Traditional Name: (3-amino-4-chloro-benzyl)-butyl-ethyl-ammonium Formula: C13H22ClN2+ MolecularWeight: 241.78018

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CC)CC1=CC(=C(C=C1)Cl)N

Isomeric SMILES

CCCC[NH+](CC)CC1=CC(=C(C=C1)Cl)N

InChI

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