N-[1-(4-chlorophenyl)ethenyl]-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium-1-amine

Systemtic Name: N-[1-(4-chlorophenyl)ethenyl]-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium-1-amine Openeye Name: N-[1-(4-chlorophenyl)vinyl]-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium-1-amine CAS Name: N-[1-(4-chlorophenyl)ethenyl]-4-[(2,4-dimethylphenyl)methyl]-1-piperazin-4-iumamine IUPAC Name: N-[1-(4-chlorophenyl)ethenyl]-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium-1-amine Traditional Name: 1-(4-chlorophenyl)vinyl-[4-(2,4-dimethylbenzyl)piperazin-4-ium-1-yl]amine Formula: C21H27ClN3+ MolecularWeight: 356.91218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C[NH+]2CCN(CC2)NC(=C)C3=CC=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)C[NH+]2CCN(CC2)NC(=C)C3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H26ClN3/c1-16-4-5-20(17(2)14-16)15-24-10-12-25(13-11-24)23-18(3)19-6-8-21(22)9-7-19/h4-9,14,23H,3,10-13,15H2,1-2H3/p+1