1-(3-chloranylpyridin-1-ium-2-yl)-4-(diphenylmethyl)piperazin-4-ium

Systemtic Name: 1-(3-chloranylpyridin-1-ium-2-yl)-4-(diphenylmethyl)piperazin-4-ium Openeye Name: 1-benzhydryl-4-(3-chloropyridin-1-ium-2-yl)piperazin-1-ium CAS Name: 1-(3-chloro-2-pyridin-1-iumyl)-4-(diphenylmethyl)piperazin-4-ium IUPAC Name: 1-benzhydryl-4-(3-chloropyridin-1-ium-2-yl)piperazin-1-ium Traditional Name: 1-benzhydryl-4-(3-chloropyridin-1-ium-2-yl)piperazin-1-ium Formula: C22H24ClN3+2 MolecularWeight: 365.89906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=C(C=CC=[NH+]4)Cl

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C4=C(C=CC=[NH+]4)Cl

InChI

InChI=1S/C22H22ClN3/c23-20-12-7-13-24-22(20)26-16-14-25(15-17-26)21(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-13,21H,14-17H2/p+2