1-[1-[2,3-bis(2-methylpropyl)phenoxy]ethoxy]ethyl-trimethyl-azanium chloride

Systemtic Name: 1-[1-[2,3-bis(2-methylpropyl)phenoxy]ethoxy]ethyl-trimethyl-azanium chloride Openeye Name: 1-[1-(2,3-diisobutylphenoxy)ethoxy]ethyl-trimethyl-ammonium chloride CAS Name: 1-[1-[2,3-bis(2-methylpropyl)phenoxy]ethoxy]ethyl-trimethylammonium chloride IUPAC Name: 1-[1-[2,3-bis(2-methylpropyl)phenoxy]ethoxy]ethyl-trimethylazanium chloride Traditional Name: 1-[1-(2,3-diisobutylphenoxy)ethoxy]ethyl-trimethyl-ammonium chloride Formula: C21H38ClNO2 MolecularWeight: 371.98492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=CC=C1)OC(C)OC(C)[N+](C)(C)C)CC(C)C.[Cl-]

Isomeric SMILES

CC(C)CC1=C(C(=CC=C1)OC(C)OC(C)[N+](C)(C)C)CC(C)C.[Cl-]

InChI

InChI=1S/C21H38NO2.ClH/c1-15(2)13-19-11-10-12-21(20(19)14-16(3)4)24-18(6)23-17(5)22(7,8)9;/h10-12,15-18H,13-14H2,1-9H3;1H/q+1;/p-1