1-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-4-ium

Systemtic Name: 1-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-4-ium Openeye Name: 1-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-4-ium CAS Name: 1-[2-(1-pyrrolidin-1-iumyl)ethyl]-1,4-diazepan-4-ium IUPAC Name: 1-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-4-ium Traditional Name: 1-(2-pyrrolidin-1-ium-1-ylethyl)-1,4-diazepan-4-ium Formula: C11H25N3+2 MolecularWeight: 199.3363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCN2CCC[NH2+]CC2

Isomeric SMILES

C1CC[NH+](C1)CCN2CCC[NH2+]CC2

InChI

InChI=1S/C11H23N3/c1-2-7-13(6-1)10-11-14-8-3-4-12-5-9-14/h12H,1-11H2/p+2