1-(5,5-dimethyl-3-pyrrolidin-1-yl-cyclohex-2-en-1-ylidene)azepan-1-ium

Systemtic Name: 1-(5,5-dimethyl-3-pyrrolidin-1-yl-cyclohex-2-en-1-ylidene)azepan-1-ium Openeye Name: 1-(5,5-dimethyl-3-pyrrolidin-1-yl-cyclohex-2-en-1-ylidene)azepan-1-ium CAS Name: 1-[5,5-dimethyl-3-(1-pyrrolidinyl)-1-cyclohex-2-enylidene]azepan-1-ium IUPAC Name: 1-(5,5-dimethyl-3-pyrrolidin-1-ylcyclohex-2-en-1-ylidene)azepan-1-ium Traditional Name: 1-(5,5-dimethyl-3-pyrrolidino-cyclohex-2-en-1-ylidene)azepan-1-ium Formula: C18H31N2+ MolecularWeight: 275.45214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=[N+]2CCCCCC2)C1)N3CCCC3)C

Isomeric SMILES

CC1(CC(=CC(=[N+]2CCCCCC2)C1)N3CCCC3)C

InChI

InChI=1S/C18H31N2/c1-18(2)14-16(19-9-5-3-4-6-10-19)13-17(15-18)20-11-7-8-12-20/h13H,3-12,14-15H2,1-2H3/q+1