diethyl-methyl-[3-[2-[oxidanyl(diphenyl)methyl]phenoxy]propyl]azanium; 4-methylbenzenesulfonate

Systemtic Name: diethyl-methyl-[3-[2-[oxidanyl(diphenyl)methyl]phenoxy]propyl]azanium; 4-methylbenzenesulfonate Openeye Name: diethyl-[3-[2-[hydroxy(diphenyl)methyl]phenoxy]propyl]-methyl-ammonium; 4-methylbenzenesulfonate CAS Name: diethyl-[3-[2-[hydroxy(diphenyl)methyl]phenoxy]propyl]-methylammonium; 4-methylbenzenesulfonate IUPAC Name: diethyl-[3-[2-[hydroxy(diphenyl)methyl]phenoxy]propyl]-methylazanium; 4-methylbenzenesulfonate Traditional Name: diethyl-[3-[2-[hydroxy(diphenyl)methyl]phenoxy]propyl]-methyl-ammonium tosylate Formula: C34H41NO5S MolecularWeight: 575.75804

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCCOC1=CC=CC=C1C(C2=CC=CC=C2)(C3=CC=CC=C3)O.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CC[N+](C)(CC)CCCOC1=CC=CC=C1C(C2=CC=CC=C2)(C3=CC=CC=C3)O.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C27H34NO2.C7H8O3S/c1-4-28(3,5-2)21-14-22-30-26-20-13-12-19-25(26)27(29,23-15-8-6-9-16-23)24-17-10-7-11-18-24;1-6-2-4-7(5-3-6)11(8,9)10/h6-13,15-20,29H,4-5,14,21-22H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1