(1-nonylquinolin-1-ium-7-yl) ethanoate

Systemtic Name: (1-nonylquinolin-1-ium-7-yl) ethanoate Openeye Name: (1-nonylquinolin-1-ium-7-yl) acetate CAS Name: acetic acid (1-nonyl-7-quinolin-1-iumyl) ester IUPAC Name: (1-nonylquinolin-1-ium-7-yl) acetate Traditional Name: acetic acid (1-nonylquinolin-1-ium-7-yl) ester Formula: C20H28NO2+ MolecularWeight: 314.44182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC[N+]1=CC=CC2=C1C=C(C=C2)OC(=O)C

Isomeric SMILES

CCCCCCCCC[N+]1=CC=CC2=C1C=C(C=C2)OC(=O)C

InChI

InChI=1S/C20H28NO2/c1-3-4-5-6-7-8-9-14-21-15-10-11-18-12-13-19(16-20(18)21)23-17(2)22/h10-13,15-16H,3-9,14H2,1-2H3/q+1