(5,5-dimethyl-3-piperidin-1-ium-1-ylidene-cyclohexen-1-yl)-(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: (5,5-dimethyl-3-piperidin-1-ium-1-ylidene-cyclohexen-1-yl)-(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: (5,5-dimethyl-3-piperidin-1-ium-1-ylidene-cyclohexen-1-yl)-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: [5,5-dimethyl-3-(1-piperidin-1-iumylidene)-1-cyclohexenyl]-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: (5,5-dimethyl-3-piperidin-1-ium-1-ylidenecyclohexen-1-yl)-(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: (5,5-dimethyl-3-piperidin-1-ium-1-ylidene-cyclohexen-1-yl)-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C21H40N3+3 MolecularWeight: 334.5624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=[N+]2CCCCC2)C1)[NH2+]CCC[NH+]3CCCCC3)C

Isomeric SMILES

CC1(CC(=CC(=[N+]2CCCCC2)C1)[NH2+]CCC[NH+]3CCCCC3)C

InChI

InChI=1S/C21H37N3/c1-21(2)17-19(16-20(18-21)24-14-7-4-8-15-24)22-10-9-13-23-11-5-3-6-12-23/h16H,3-15,17-18H2,1-2H3/p+3