dimethyl-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]azanium

Systemtic Name: dimethyl-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]azanium Openeye Name: 4-[4-(1,1-dimethylpropyl)phenoxy]butyl-dimethyl-ammonium CAS Name: dimethyl-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]ammonium IUPAC Name: dimethyl-[4-[4-(2-methylbutan-2-yl)phenoxy]butyl]azanium Traditional Name: 4-(4-tert-amylphenoxy)butyl-dimethyl-ammonium Formula: C17H30NO+ MolecularWeight: 264.4262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCCCC[NH+](C)C

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCCCC[NH+](C)C

InChI

InChI=1S/C17H29NO/c1-6-17(2,3)15-9-11-16(12-10-15)19-14-8-7-13-18(4)5/h9-12H,6-8,13-14H2,1-5H3/p+1