butyl sulfate; hexadecylazanium

Systemtic Name: butyl sulfate; hexadecylazanium Openeye Name: butyl sulfate; hexadecylammonium CAS Name: butyl sulfate; hexadecylammonium IUPAC Name: butyl sulfate; hexadecylazanium Traditional Name: butyl sulfate; cetylammonium Formula: C20H45NO4S MolecularWeight: 395.6406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[NH3+].CCCCOS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[NH3+].CCCCOS(=O)(=O)[O-]

InChI

InChI=1S/C16H35N.C4H10O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17;1-2-3-4-8-9(5,6)7/h2-17H2,1H3;2-4H2,1H3,(H,5,6,7)