1-[1-[2-(2-bromophenyl)ethyl]pyridin-1-ium-2-yl]-1,2-dicyclohexyl-guanidine

Systemtic Name: 1-[1-[2-(2-bromophenyl)ethyl]pyridin-1-ium-2-yl]-1,2-dicyclohexyl-guanidine Openeye Name: 1-[1-[2-(2-bromophenyl)ethyl]pyridin-1-ium-2-yl]-1,2-dicyclohexyl-guanidine CAS Name: 1-[1-[2-(2-bromophenyl)ethyl]-2-pyridin-1-iumyl]-1,2-dicyclohexylguanidine IUPAC Name: 1-[1-[2-(2-bromophenyl)ethyl]pyridin-1-ium-2-yl]-1,2-dicyclohexylguanidine Traditional Name: 1-[1-[2-(2-bromophenyl)ethyl]pyridin-1-ium-2-yl]-1,2-dicyclohexyl-guanidine Formula: C26H36BrN4+ MolecularWeight: 484.49484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C(N)N(C2CCCCC2)C3=CC=CC=[N+]3CCC4=CC=CC=C4Br

Isomeric SMILES

C1CCC(CC1)N=C(N)N(C2CCCCC2)C3=CC=CC=[N+]3CCC4=CC=CC=C4Br

InChI

InChI=1S/C26H36BrN4/c27-24-16-8-7-11-21(24)18-20-30-19-10-9-17-25(30)31(23-14-5-2-6-15-23)26(28)29-22-12-3-1-4-13-22/h7-11,16-17,19,22-23H,1-6,12-15,18,20H2,(H2,28,29)/q+1