2,2-bis[(E)-hexadec-9-enoxy]ethyl-(2-hydroxyethyl)-methyl-azanium; methoxy sulfate

Systemtic Name: 2,2-bis[(E)-hexadec-9-enoxy]ethyl-(2-hydroxyethyl)-methyl-azanium; methoxy sulfate Openeye Name: 2,2-bis[(E)-hexadec-9-enoxy]ethyl-(2-hydroxyethyl)-methyl-ammonium; methoxy sulfate CAS Name: 2,2-bis[(E)-hexadec-9-enoxy]ethyl-(2-hydroxyethyl)-methylammonium; methoxy sulfate IUPAC Name: 2,2-bis[(E)-hexadec-9-enoxy]ethyl-(2-hydroxyethyl)-methylazanium; methoxy sulfate Traditional Name: 2,2-bis[(E)-hexadec-9-enoxy]ethyl-(2-hydroxyethyl)-methyl-ammonium; methoxy sulfate Formula: C38H77NO8S MolecularWeight: 708.08488

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CCCCCCCCCOC(C[NH+](C)CCO)OCCCCCCCCC=CCCCCCC.COOS(=O)(=O)[O-]

Isomeric SMILES

CCCCCC/C=C/CCCCCCCCOC(OCCCCCCCC/C=C/CCCCCC)C[NH+](CCO)C.COOS(=O)(=O)[O-]

InChI

InChI=1S/C37H73NO3.CH4O5S/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-34-40-37(36-38(3)32-33-39)41-35-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;1-5-6-7(2,3)4/h14-17,37,39H,4-13,18-36H2,1-3H3;1H3,(H,2,3,4)/b16-14+,17-15+;