dimethyl-(1-phenylpropan-2-yl)-[3,3,4,4-tetramethyl-2-(4-methylphenoxy)hexoxy]azanium

Systemtic Name: dimethyl-(1-phenylpropan-2-yl)-[3,3,4,4-tetramethyl-2-(4-methylphenoxy)hexoxy]azanium Openeye Name: dimethyl-(1-methyl-2-phenyl-ethyl)-[3,3,4,4-tetramethyl-2-(4-methylphenoxy)hexoxy]ammonium CAS Name: dimethyl-(1-phenylpropan-2-yl)-[3,3,4,4-tetramethyl-2-(4-methylphenoxy)hexoxy]ammonium IUPAC Name: dimethyl-(1-phenylpropan-2-yl)-[3,3,4,4-tetramethyl-2-(4-methylphenoxy)hexoxy]azanium Traditional Name: dimethyl-(1-methyl-2-phenyl-ethyl)-[3,3,4,4-tetramethyl-2-(4-methylphenoxy)hexoxy]ammonium Formula: C28H44NO2+ MolecularWeight: 426.65446

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(C)(C)C(CO[N+](C)(C)C(C)CC1=CC=CC=C1)OC2=CC=C(C=C2)C

Isomeric SMILES

CCC(C)(C)C(C)(C)C(CO[N+](C)(C)C(C)CC1=CC=CC=C1)OC2=CC=C(C=C2)C

InChI

InChI=1S/C28H44NO2/c1-10-27(4,5)28(6,7)26(31-25-18-16-22(2)17-19-25)21-30-29(8,9)23(3)20-24-14-12-11-13-15-24/h11-19,23,26H,10,20-21H2,1-9H3/q+1