1-methyl-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carbonitrile

Systemtic Name: 1-methyl-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carbonitrile Openeye Name: 1-methyl-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carbonitrile CAS Name: 1-methyl-4-(1-piperidin-1-iumyl)-4-piperidin-1-iumcarbonitrile IUPAC Name: 1-methyl-4-piperidin-1-ium-1-ylpiperidin-1-ium-4-carbonitrile Traditional Name: 1-methyl-4-piperidin-1-ium-1-yl-piperidin-1-ium-4-carbonitrile Formula: C12H23N3+2 MolecularWeight: 209.33112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)(C#N)[NH+]2CCCCC2

Isomeric SMILES

C[NH+]1CCC(CC1)(C#N)[NH+]2CCCCC2

InChI

InChI=1S/C12H21N3/c1-14-9-5-12(11-13,6-10-14)15-7-3-2-4-8-15/h2-10H2,1H3/p+2