ethyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium; ethyl sulfate

Systemtic Name: ethyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium; ethyl sulfate Openeye Name: ethyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]ammonium; ethyl sulfate CAS Name: ethyl-dimethyl-[3-[(16-methyl-1-oxoheptadecyl)amino]propyl]ammonium; ethyl sulfate IUPAC Name: ethyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium; ethyl sulfate Traditional Name: ethyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]ammonium; ethyl sulfate Formula: C27H58N2O5S MolecularWeight: 522.82482

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCC(C)C.CCOS(=O)(=O)[O-]

Isomeric SMILES

CC[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCC(C)C.CCOS(=O)(=O)[O-]

InChI

InChI=1S/C25H52N2O.C2H6O4S/c1-6-27(4,5)23-19-22-26-25(28)21-18-16-14-12-10-8-7-9-11-13-15-17-20-24(2)3;1-2-6-7(3,4)5/h24H,6-23H2,1-5H3;2H2,1H3,(H,3,4,5)