[3-di(butan-2-yloxy)phosphoryloxyphenyl]-trimethyl-azanium; methyl sulfate

Systemtic Name: [3-di(butan-2-yloxy)phosphoryloxyphenyl]-trimethyl-azanium; methyl sulfate Openeye Name: (3-disec-butoxyphosphoryloxyphenyl)-trimethyl-ammonium; methyl sulfate CAS Name: [3-di(butan-2-yloxy)phosphoryloxyphenyl]-trimethylammonium; methyl sulfate IUPAC Name: [3-di(butan-2-yloxy)phosphoryloxyphenyl]-trimethylazanium; methyl sulfate Traditional Name: (3-disec-butoxyphosphoryloxyphenyl)-trimethyl-ammonium; methyl sulfate Formula: C18H34NO8PS MolecularWeight: 455.503221

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OP(=O)(OC1=CC=CC(=C1)[N+](C)(C)C)OC(C)CC.COS(=O)(=O)[O-]

Isomeric SMILES

CCC(C)OP(=O)(OC1=CC=CC(=C1)[N+](C)(C)C)OC(C)CC.COS(=O)(=O)[O-]

InChI

InChI=1S/C17H31NO4P.CH4O4S/c1-8-14(3)20-23(19,21-15(4)9-2)22-17-12-10-11-16(13-17)18(5,6)7;1-5-6(2,3)4/h10-15H,8-9H2,1-7H3;1H3,(H,2,3,4)/q+1;/p-1