4-(2,4-dimethylphenoxy)butyl-methyl-(phenylmethyl)azanium

Systemtic Name: 4-(2,4-dimethylphenoxy)butyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[4-(2,4-dimethylphenoxy)butyl]-methyl-ammonium CAS Name: 4-(2,4-dimethylphenoxy)butyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[4-(2,4-dimethylphenoxy)butyl]-methylazanium Traditional Name: benzyl-[4-(2,4-dimethylphenoxy)butyl]-methyl-ammonium Formula: C20H28NO+ MolecularWeight: 298.44242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC[NH+](C)CC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC[NH+](C)CC2=CC=CC=C2)C

InChI

InChI=1S/C20H27NO/c1-17-11-12-20(18(2)15-17)22-14-8-7-13-21(3)16-19-9-5-4-6-10-19/h4-6,9-12,15H,7-8,13-14,16H2,1-3H3/p+1