1-(4-heptadecyl-5-methyl-1,3-dithiol-2-ylidene)piperidin-1-ium

Systemtic Name: 1-(4-heptadecyl-5-methyl-1,3-dithiol-2-ylidene)piperidin-1-ium Openeye Name: 1-(4-heptadecyl-5-methyl-1,3-dithiol-2-ylidene)piperidin-1-ium CAS Name: 1-(4-heptadecyl-5-methyl-1,3-dithiol-2-ylidene)piperidin-1-ium IUPAC Name: 1-(4-heptadecyl-5-methyl-1,3-dithiol-2-ylidene)piperidin-1-ium Traditional Name: 1-(4-heptadecyl-5-methyl-1,3-dithiol-2-ylidene)piperidin-1-ium Formula: C26H48NS2+ MolecularWeight: 438.79602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=C(SC(=[N+]2CCCCC2)S1)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=C(SC(=[N+]2CCCCC2)S1)C

InChI

InChI=1S/C26H48NS2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-25-24(2)28-26(29-25)27-22-19-17-20-23-27/h3-23H2,1-2H3/q+1