N-[prop-2-enylsulfanyl(pyrrolidin-1-ium-1-ylidene)methyl]prop-2-en-1-amine bromide

Systemtic Name: N-[prop-2-enylsulfanyl(pyrrolidin-1-ium-1-ylidene)methyl]prop-2-en-1-amine bromide Openeye Name: N-[allylsulfanyl(pyrrolidin-1-ium-1-ylidene)methyl]prop-2-en-1-amine bromide CAS Name: N-[(prop-2-enylthio)-(1-pyrrolidin-1-iumylidene)methyl]-2-propen-1-amine bromide IUPAC Name: N-[prop-2-enylsulfanyl(pyrrolidin-1-ium-1-ylidene)methyl]prop-2-en-1-amine bromide Traditional Name: allyl-[(allylthio)-pyrrolidin-1-ium-1-ylidene-methyl]amine bromide Formula: C11H19BrN2S MolecularWeight: 291.25096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=[N+]1CCCC1)SCC=C.[Br-]

Isomeric SMILES

C=CCNC(=[N+]1CCCC1)SCC=C.[Br-]

InChI

InChI=1S/C11H18N2S.BrH/c1-3-7-12-11(14-10-4-2)13-8-5-6-9-13;/h3-4H,1-2,5-10H2;1H