(1-methylquinolin-1-ium-8-yl) dodecanoate

Systemtic Name: (1-methylquinolin-1-ium-8-yl) dodecanoate Openeye Name: (1-methylquinolin-1-ium-8-yl) dodecanoate CAS Name: dodecanoic acid (1-methyl-8-quinolin-1-iumyl) ester IUPAC Name: (1-methylquinolin-1-ium-8-yl) dodecanoate Traditional Name: lauric acid (1-methylquinolin-1-ium-8-yl) ester Formula: C22H32NO2+ MolecularWeight: 342.49498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)OC1=CC=CC2=C1[N+](=CC=C2)C

Isomeric SMILES

CCCCCCCCCCCC(=O)OC1=CC=CC2=C1[N+](=CC=C2)C

InChI

InChI=1S/C22H32NO2/c1-3-4-5-6-7-8-9-10-11-17-21(24)25-20-16-12-14-19-15-13-18-23(2)22(19)20/h12-16,18H,3-11,17H2,1-2H3/q+1