3-methylsulfanyl-1-morpholin-4-yl-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridin-2-ium-4-carbonitrile

Systemtic Name: 3-methylsulfanyl-1-morpholin-4-yl-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridin-2-ium-4-carbonitrile Openeye Name: 3-methylsulfanyl-1-morpholino-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridin-2-ium-4-carbonitrile CAS Name: 3-(methylthio)-1-(4-morpholinyl)-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridin-2-ium-4-carbonitrile IUPAC Name: 3-methylsulfanyl-1-morpholin-4-yl-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridin-2-ium-4-carbonitrile Traditional Name: 3-(methylthio)-1-morpholino-6,7,8,9-tetrahydro-5H-cyclohepta[c]pyridin-2-ium-4-carbonitrile Formula: C16H22N3OS+ MolecularWeight: 304.43038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=[NH+]C(=C2CCCCCC2=C1C#N)N3CCOCC3

Isomeric SMILES

CSC1=[NH+]C(=C2CCCCCC2=C1C#N)N3CCOCC3

InChI

InChI=1S/C16H21N3OS/c1-21-16-14(11-17)12-5-3-2-4-6-13(12)15(18-16)19-7-9-20-10-8-19/h2-10H2,1H3/p+1