4-[2-(4-methoxyphenyl)sulfanylethyl]pyridin-1-ium

Systemtic Name: 4-[2-(4-methoxyphenyl)sulfanylethyl]pyridin-1-ium Openeye Name: 4-[2-(4-methoxyphenyl)sulfanylethyl]pyridin-1-ium CAS Name: 4-[2-[(4-methoxyphenyl)thio]ethyl]pyridin-1-ium IUPAC Name: 4-[2-(4-methoxyphenyl)sulfanylethyl]pyridin-1-ium Traditional Name: 4-[2-[(4-methoxyphenyl)thio]ethyl]pyridin-1-ium Formula: C14H16NOS+ MolecularWeight: 246.34794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCC2=CC=[NH+]C=C2

Isomeric SMILES

COC1=CC=C(C=C1)SCCC2=CC=[NH+]C=C2

InChI

InChI=1S/C14H15NOS/c1-16-13-2-4-14(5-3-13)17-11-8-12-6-9-15-10-7-12/h2-7,9-10H,8,11H2,1H3/p+1