2-[(4-methoxyphenyl)-piperidin-1-ium-1-ylidene-methyl]sulfanylethanenitrile

Systemtic Name: 2-[(4-methoxyphenyl)-piperidin-1-ium-1-ylidene-methyl]sulfanylethanenitrile Openeye Name: 2-[(4-methoxyphenyl)-piperidin-1-ium-1-ylidene-methyl]sulfanylacetonitrile CAS Name: 2-[[(4-methoxyphenyl)-(1-piperidin-1-iumylidene)methyl]thio]acetonitrile IUPAC Name: 2-[(4-methoxyphenyl)-piperidin-1-ium-1-ylidenemethyl]sulfanylacetonitrile Traditional Name: 2-[[(4-methoxyphenyl)-piperidin-1-ium-1-ylidene-methyl]thio]acetonitrile Formula: C15H19N2OS+ MolecularWeight: 275.38916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=[N+]2CCCCC2)SCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=[N+]2CCCCC2)SCC#N

InChI

InChI=1S/C15H19N2OS/c1-18-14-7-5-13(6-8-14)15(19-12-9-16)17-10-3-2-4-11-17/h5-8H,2-4,10-12H2,1H3/q+1