4-[1-[[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]amino]ethenyl]-2-methoxy-phenol

Systemtic Name: 4-[1-[[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]amino]ethenyl]-2-methoxy-phenol Openeye Name: 4-[1-[[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]amino]vinyl]-2-methoxy-phenol CAS Name: 4-[1-[[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]amino]ethenyl]-2-methoxyphenol IUPAC Name: 4-[1-[[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]amino]ethenyl]-2-methoxyphenol Traditional Name: 4-[1-[[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]amino]vinyl]-2-methoxy-phenol Formula: C20H25ClN3O2+ MolecularWeight: 374.8844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=C)NN2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=C)NN2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C20H24ClN3O2/c1-15(17-5-8-19(25)20(13-17)26-2)22-24-11-9-23(10-12-24)14-16-3-6-18(21)7-4-16/h3-8,13,22,25H,1,9-12,14H2,2H3/p+1