2-methoxyethyl 2-(3-methyl-1H-imidazol-3-ium-2-yl)ethanoate; octyl sulfate

Systemtic Name: 2-methoxyethyl 2-(3-methyl-1H-imidazol-3-ium-2-yl)ethanoate; octyl sulfate Openeye Name: 2-methoxyethyl 2-(3-methyl-1H-imidazol-3-ium-2-yl)acetate; octyl sulfate CAS Name: 2-(3-methyl-1H-imidazol-3-ium-2-yl)acetic acid 2-methoxyethyl ester; octyl sulfate IUPAC Name: 2-methoxyethyl 2-(3-methyl-1H-imidazol-3-ium-2-yl)acetate; octyl sulfate Traditional Name: 2-(3-methyl-1H-imidazol-3-ium-2-yl)acetic acid 2-methoxyethyl ester; octyl sulfate Formula: C17H32N2O7S MolecularWeight: 408.51018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOS(=O)(=O)[O-].C[N+]1=C(NC=C1)CC(=O)OCCOC

Isomeric SMILES

CCCCCCCCOS(=O)(=O)[O-].C[N+]1=C(NC=C1)CC(=O)OCCOC

InChI

InChI=1S/C9H14N2O3.C8H18O4S/c1-11-4-3-10-8(11)7-9(12)14-6-5-13-2;1-2-3-4-5-6-7-8-12-13(9,10)11/h3-4H,5-7H2,1-2H3;2-8H2,1H3,(H,9,10,11)