2-[3-ethyl-2-[(E)-heptadec-8-enyl]-4,5-dihydroimidazol-1-ium-1-yl]ethanol; hydrogen sulfate

Systemtic Name: 2-[3-ethyl-2-[(E)-heptadec-8-enyl]-4,5-dihydroimidazol-1-ium-1-yl]ethanol; hydrogen sulfate Openeye Name: 2-[3-ethyl-2-[(E)-heptadec-8-enyl]-4,5-dihydroimidazol-1-ium-1-yl]ethanol; hydrogen sulfate CAS Name: 2-[3-ethyl-2-[(E)-heptadec-8-enyl]-4,5-dihydroimidazol-1-ium-1-yl]ethanol; hydrogen sulfate IUPAC Name: 2-[3-ethyl-2-[(E)-heptadec-8-enyl]-4,5-dihydroimidazol-1-ium-1-yl]ethanol; hydrogen sulfate Traditional Name: 2-[3-ethyl-2-[(E)-heptadec-8-enyl]-2-imidazolin-1-ium-1-yl]ethanol bisulfate Formula: C24H48N2O5S MolecularWeight: 476.71332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC1=[N+](CCN1CC)CCO.OS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC1=[N+](CCN1CC)CCO.OS(=O)(=O)[O-]

InChI

InChI=1S/C24H47N2O.H2O4S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-25(4-2)20-21-26(24)22-23-27;1-5(2,3)4/h11-12,27H,3-10,13-23H2,1-2H3;(H2,1,2,3,4)/q+1;/p-1/b12-11+;