2-ethenyl-1-propyl-quinolin-1-ium; methyl sulfate

Systemtic Name: 2-ethenyl-1-propyl-quinolin-1-ium; methyl sulfate Openeye Name: methyl sulfate; 1-propyl-2-vinyl-quinolin-1-ium CAS Name: 2-ethenyl-1-propylquinolin-1-ium; methyl sulfate IUPAC Name: 2-ethenyl-1-propylquinolin-1-ium; methyl sulfate Traditional Name: methyl sulfate; 1-propyl-2-vinyl-quinolin-1-ium Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C(C=CC2=CC=CC=C21)C=C.COS(=O)(=O)[O-]

Isomeric SMILES

CCC[N+]1=C(C=CC2=CC=CC=C21)C=C.COS(=O)(=O)[O-]

InChI

InChI=1S/C14H16N.CH4O4S/c1-3-11-15-13(4-2)10-9-12-7-5-6-8-14(12)15;1-5-6(2,3)4/h4-10H,2-3,11H2,1H3;1H3,(H,2,3,4)/q+1;/p-1