1-(4-chlorophenyl)-4-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperazin-4-ium

Systemtic Name: 1-(4-chlorophenyl)-4-[1-(phenylmethyl)piperidin-1-ium-4-yl]piperazin-4-ium Openeye Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-(4-chlorophenyl)piperazin-1-ium CAS Name: 1-(4-chlorophenyl)-4-[1-(phenylmethyl)-4-piperidin-1-iumyl]piperazin-4-ium IUPAC Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-(4-chlorophenyl)piperazin-1-ium Traditional Name: 1-(1-benzylpiperidin-1-ium-4-yl)-4-(4-chlorophenyl)piperazin-1-ium Formula: C22H30ClN3+2 MolecularWeight: 371.9467

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1[NH+]2CCN(CC2)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1[NH+]2CCN(CC2)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C22H28ClN3/c23-20-6-8-21(9-7-20)25-14-16-26(17-15-25)22-10-12-24(13-11-22)18-19-4-2-1-3-5-19/h1-9,22H,10-18H2/p+2