6,8-bis(chloranyl)-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]chromen-4-one

Systemtic Name: 6,8-bis(chloranyl)-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]chromen-4-one Openeye Name: 6,8-dichloro-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]chromen-4-one CAS Name: 6,8-dichloro-3-[(4-ethyl-1-piperazin-4-iumyl)methyl]-1-benzopyran-4-one IUPAC Name: 6,8-dichloro-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]chromen-4-one Traditional Name: 6,8-dichloro-3-[(4-ethylpiperazin-4-ium-1-yl)methyl]chromone Formula: C16H19Cl2N2O2+ MolecularWeight: 342.24026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=COC3=C(C=C(C=C3C2=O)Cl)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=COC3=C(C=C(C=C3C2=O)Cl)Cl

InChI

InChI=1S/C16H18Cl2N2O2/c1-2-19-3-5-20(6-4-19)9-11-10-22-16-13(15(11)21)7-12(17)8-14(16)18/h7-8,10H,2-6,9H2,1H3/p+1