2-(4-chlorophenyl)ethyl-pentan-3-yl-azanium

Systemtic Name: 2-(4-chlorophenyl)ethyl-pentan-3-yl-azanium Openeye Name: 2-(4-chlorophenyl)ethyl-(1-ethylpropyl)ammonium CAS Name: 2-(4-chlorophenyl)ethyl-pentan-3-ylammonium IUPAC Name: 2-(4-chlorophenyl)ethyl-pentan-3-ylazanium Traditional Name: 2-(4-chlorophenyl)ethyl-(1-ethylpropyl)ammonium Formula: C13H21ClN+ MolecularWeight: 226.76554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CCC1=CC=C(C=C1)Cl

Isomeric SMILES

CCC(CC)[NH2+]CCC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H20ClN/c1-3-13(4-2)15-10-9-11-5-7-12(14)8-6-11/h5-8,13,15H,3-4,9-10H2,1-2H3/p+1