2-chloranyl-1-(1-ethenylcycloheptyl)-1-piperidin-4-yl-benzimidazol-1-ium

Systemtic Name: 2-chloranyl-1-(1-ethenylcycloheptyl)-1-piperidin-4-yl-benzimidazol-1-ium Openeye Name: 2-chloro-1-(4-piperidyl)-1-(1-vinylcycloheptyl)benzimidazol-1-ium CAS Name: 2-chloro-1-(1-ethenylcycloheptyl)-1-(4-piperidinyl)benzimidazol-1-ium IUPAC Name: 2-chloro-1-(1-ethenylcycloheptyl)-1-piperidin-4-ylbenzimidazol-1-ium Traditional Name: 2-chloro-1-(4-piperidyl)-1-(1-vinylcycloheptyl)benzimidazol-1-ium Formula: C21H29ClN3+ MolecularWeight: 358.92806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC1(CCCCCC1)[N+]2(C3=CC=CC=C3N=C2Cl)C4CCNCC4

Isomeric SMILES

C=CC1(CCCCCC1)[N+]2(C3=CC=CC=C3N=C2Cl)C4CCNCC4

InChI

InChI=1S/C21H29ClN3/c1-2-21(13-7-3-4-8-14-21)25(17-11-15-23-16-12-17)19-10-6-5-9-18(19)24-20(25)22/h2,5-6,9-10,17,23H,1,3-4,7-8,11-16H2/q+1