2-[4-(diphenylmethyl)piperazin-1-yl]pyridin-1-ium-3-amine

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-yl]pyridin-1-ium-3-amine Openeye Name: 2-(4-benzhydrylpiperazin-1-yl)pyridin-1-ium-3-amine CAS Name: 2-[4-(diphenylmethyl)-1-piperazinyl]-3-pyridin-1-iumamine IUPAC Name: 2-(4-benzhydrylpiperazin-1-yl)pyridin-1-ium-3-amine Traditional Name: [2-(4-benzhydrylpiperazino)pyridin-1-ium-3-yl]amine Formula: C22H25N4+ MolecularWeight: 345.4607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=[NH+]2)N)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=[NH+]2)N)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4/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,14-17,23H2/p+1