3-(4-cyclohex-3-en-1-ylpyridin-1-ium-1-yl)propane-1-sulfonate

Systemtic Name: 3-(4-cyclohex-3-en-1-ylpyridin-1-ium-1-yl)propane-1-sulfonate Openeye Name: 3-(4-cyclohex-3-en-1-ylpyridin-1-ium-1-yl)propane-1-sulfonate CAS Name: 3-[4-(1-cyclohex-3-enyl)-1-pyridin-1-iumyl]-1-propanesulfonate IUPAC Name: 3-(4-cyclohex-3-en-1-ylpyridin-1-ium-1-yl)propane-1-sulfonate Traditional Name: 3-(4-cyclohex-3-en-1-ylpyridin-1-ium-1-yl)propane-1-sulfonate Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C2=CC=[N+](C=C2)CCCS(=O)(=O)[O-]

Isomeric SMILES

C1CC(CC=C1)C2=CC=[N+](C=C2)CCCS(=O)(=O)[O-]

InChI

InChI=1S/C14H19NO3S/c16-19(17,18)12-4-9-15-10-7-14(8-11-15)13-5-2-1-3-6-13/h1-2,7-8,10-11,13H,3-6,9,12H2