methyl 2-(6-methoxy-2-methyl-quinolin-1-ium-4-yl)sulfanylethanoate

Systemtic Name: methyl 2-(6-methoxy-2-methyl-quinolin-1-ium-4-yl)sulfanylethanoate Openeye Name: methyl 2-(6-methoxy-2-methyl-quinolin-1-ium-4-yl)sulfanylacetate CAS Name: 2-[(6-methoxy-2-methyl-4-quinolin-1-iumyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(6-methoxy-2-methylquinolin-1-ium-4-yl)sulfanylacetate Traditional Name: 2-[(6-methoxy-2-methyl-quinolin-1-ium-4-yl)thio]acetic acid methyl ester Formula: C14H16NO3S+ MolecularWeight: 278.34674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[NH+]C2=C(C=C(C=C2)OC)C(=C1)SCC(=O)OC

Isomeric SMILES

CC1=[NH+]C2=C(C=C(C=C2)OC)C(=C1)SCC(=O)OC

InChI

InChI=1S/C14H15NO3S/c1-9-6-13(19-8-14(16)18-3)11-7-10(17-2)4-5-12(11)15-9/h4-7H,8H2,1-3H3/p+1