(2-methylquinolin-1-ium-8-yl) 4-methoxybenzoate

Systemtic Name: (2-methylquinolin-1-ium-8-yl) 4-methoxybenzoate Openeye Name: (2-methylquinolin-1-ium-8-yl) 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid (2-methyl-8-quinolin-1-iumyl) ester IUPAC Name: (2-methylquinolin-1-ium-8-yl) 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid (2-methylquinolin-1-ium-8-yl) ester Formula: C18H16NO3+ MolecularWeight: 294.32454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=C(C=CC=C2OC(=O)C3=CC=C(C=C3)OC)C=C1

Isomeric SMILES

CC1=[NH+]C2=C(C=CC=C2OC(=O)C3=CC=C(C=C3)OC)C=C1

InChI

InChI=1S/C18H15NO3/c1-12-6-7-13-4-3-5-16(17(13)19-12)22-18(20)14-8-10-15(21-2)11-9-14/h3-11H,1-2H3/p+1