2-[2-(4-ethylphenyl)-4-methyl-quinolin-1-ium-3-yl]ethanoate

Systemtic Name: 2-[2-(4-ethylphenyl)-4-methyl-quinolin-1-ium-3-yl]ethanoate Openeye Name: 2-[2-(4-ethylphenyl)-4-methyl-quinolin-1-ium-3-yl]acetate CAS Name: 2-[2-(4-ethylphenyl)-4-methyl-3-quinolin-1-iumyl]acetate IUPAC Name: 2-[2-(4-ethylphenyl)-4-methylquinolin-1-ium-3-yl]acetate Traditional Name: 2-[2-(4-ethylphenyl)-4-methyl-quinolin-1-ium-3-yl]acetate Formula: C20H19NO2 MolecularWeight: 305.37036

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=[NH+]C3=CC=CC=C3C(=C2CC(=O)[O-])C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=[NH+]C3=CC=CC=C3C(=C2CC(=O)[O-])C

InChI

InChI=1S/C20H19NO2/c1-3-14-8-10-15(11-9-14)20-17(12-19(22)23)13(2)16-6-4-5-7-18(16)21-20/h4-11H,3,12H2,1-2H3,(H,22,23)