N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(4-phenylphenyl)ethanimine

Systemtic Name: N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(4-phenylphenyl)ethanimine Openeye Name: N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(4-phenylphenyl)ethanimine CAS Name: N-[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]-1-(4-phenylphenyl)ethanimine IUPAC Name: N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(4-phenylphenyl)ethanimine Traditional Name: (E)-[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]-[1-(4-phenylphenyl)ethylidene]amine Formula: C25H27ClN3+ MolecularWeight: 404.95498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NN1CC[NH+](CC1)CC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C/C(=N\N1CC[NH+](CC1)CC2=CC=C(C=C2)Cl)/C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H26ClN3/c1-20(22-9-11-24(12-10-22)23-5-3-2-4-6-23)27-29-17-15-28(16-18-29)19-21-7-13-25(26)14-8-21/h2-14H,15-19H2,1H3/p+1/b27-20+