2-hydroxyethyl(trimethyl)azanium; methyl sulfate; phenoxybenzene

Systemtic Name: 2-hydroxyethyl(trimethyl)azanium; methyl sulfate; phenoxybenzene Openeye Name: 2-hydroxyethyl(trimethyl)ammonium; methyl sulfate; phenoxybenzene CAS Name: 2-hydroxyethyl(trimethyl)ammonium; methyl sulfate; phenoxybenzene IUPAC Name: 2-hydroxyethyl(trimethyl)azanium; methyl sulfate; phenoxybenzene Traditional Name: 2-hydroxyethyl(trimethyl)ammonium; methyl sulfate; phenoxybenzene Formula: C18H27NO6S MolecularWeight: 385.47508

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCO.COS(=O)(=O)[O-].C1=CC=C(C=C1)OC2=CC=CC=C2

Isomeric SMILES

C[N+](C)(C)CCO.COS(=O)(=O)[O-].C1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C12H10O.C5H14NO.CH4O4S/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-6(2,3)4-5-7;1-5-6(2,3)4/h1-10H;7H,4-5H2,1-3H3;1H3,(H,2,3,4)/q;+1;/p-1