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

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)-4-methyl-quinolin-1-ium-3-yl]ethanoate Openeye Name: 2-[2-(3,4-dimethoxyphenyl)-4-methyl-quinolin-1-ium-3-yl]acetate CAS Name: 2-[2-(3,4-dimethoxyphenyl)-4-methyl-3-quinolin-1-iumyl]acetate IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)-4-methylquinolin-1-ium-3-yl]acetate Traditional Name: 2-[2-(3,4-dimethoxyphenyl)-4-methyl-quinolin-1-ium-3-yl]acetate Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[NH+]C2=CC=CC=C12)C3=CC(=C(C=C3)OC)OC)CC(=O)[O-]

Isomeric SMILES

CC1=C(C(=[NH+]C2=CC=CC=C12)C3=CC(=C(C=C3)OC)OC)CC(=O)[O-]

InChI

InChI=1S/C20H19NO4/c1-12-14-6-4-5-7-16(14)21-20(15(12)11-19(22)23)13-8-9-17(24-2)18(10-13)25-3/h4-10H,11H2,1-3H3,(H,22,23)