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

Systemtic Name: 2-[4-methyl-2-(4-methylphenyl)quinolin-1-ium-3-yl]ethanoate Openeye Name: 2-[4-methyl-2-(p-tolyl)quinolin-1-ium-3-yl]acetate CAS Name: 2-[4-methyl-2-(4-methylphenyl)-3-quinolin-1-iumyl]acetate IUPAC Name: 2-[4-methyl-2-(4-methylphenyl)quinolin-1-ium-3-yl]acetate Traditional Name: 2-[4-methyl-2-(p-tolyl)quinolin-1-ium-3-yl]acetate Formula: C19H17NO2 MolecularWeight: 291.34378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=[NH+]C3=CC=CC=C3C(=C2CC(=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C2=[NH+]C3=CC=CC=C3C(=C2CC(=O)[O-])C

InChI

InChI=1S/C19H17NO2/c1-12-7-9-14(10-8-12)19-16(11-18(21)22)13(2)15-5-3-4-6-17(15)20-19/h3-10H,11H2,1-2H3,(H,21,22)