(E)-3-phenyl-N-[(1R)-2,2,2-tris(chloranyl)-1-(4-phenylpiperazin-1-ium-1-yl)ethyl]prop-2-enamide

Systemtic Name: (E)-3-phenyl-N-[(1R)-2,2,2-tris(chloranyl)-1-(4-phenylpiperazin-1-ium-1-yl)ethyl]prop-2-enamide Openeye Name: (E)-3-phenyl-N-[(1R)-2,2,2-trichloro-1-(4-phenylpiperazin-1-ium-1-yl)ethyl]prop-2-enamide CAS Name: (E)-3-phenyl-N-[(1R)-2,2,2-trichloro-1-(4-phenyl-1-piperazin-1-iumyl)ethyl]-2-propenamide IUPAC Name: (E)-3-phenyl-N-[(1R)-2,2,2-trichloro-1-(4-phenylpiperazin-1-ium-1-yl)ethyl]prop-2-enamide Traditional Name: (E)-3-phenyl-N-[(1R)-2,2,2-trichloro-1-(4-phenylpiperazin-1-ium-1-yl)ethyl]acrylamide Formula: C21H23Cl3N3O+ MolecularWeight: 439.78582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C(Cl)(Cl)Cl)NC(=O)C=CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1[C@H](C(Cl)(Cl)Cl)NC(=O)/C=C/C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22Cl3N3O/c22-21(23,24)20(25-19(28)12-11-17-7-3-1-4-8-17)27-15-13-26(14-16-27)18-9-5-2-6-10-18/h1-12,20H,13-16H2,(H,25,28)/p+1/b12-11+/t20-/m1/s1