(E)-3-(2,4-dichlorophenyl)-1-piperazin-4-ium-1-yl-prop-2-en-1-one

Systemtic Name: (E)-3-(2,4-dichlorophenyl)-1-piperazin-4-ium-1-yl-prop-2-en-1-one Openeye Name: (E)-3-(2,4-dichlorophenyl)-1-piperazin-4-ium-1-yl-prop-2-en-1-one CAS Name: (E)-3-(2,4-dichlorophenyl)-1-(1-piperazin-4-iumyl)-2-propen-1-one IUPAC Name: (E)-3-(2,4-dichlorophenyl)-1-piperazin-4-ium-1-ylprop-2-en-1-one Traditional Name: (E)-3-(2,4-dichlorophenyl)-1-piperazin-4-ium-1-yl-prop-2-en-1-one Formula: C13H15Cl2N2O+ MolecularWeight: 286.177

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C=CC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)/C=C/C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H14Cl2N2O/c14-11-3-1-10(12(15)9-11)2-4-13(18)17-7-5-16-6-8-17/h1-4,9,16H,5-8H2/p+1/b4-2+