6,8-bis(chloranyl)-3-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]chromen-4-one

Systemtic Name: 6,8-bis(chloranyl)-3-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]chromen-4-one Openeye Name: 6,8-dichloro-3-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]chromen-4-one CAS Name: 6,8-dichloro-3-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-1-benzopyran-4-one IUPAC Name: 6,8-dichloro-3-[(4-pyridin-1-ium-2-ylpiperazin-1-yl)methyl]chromen-4-one Traditional Name: 6,8-dichloro-3-[(4-pyridin-1-ium-2-ylpiperazino)methyl]chromone Formula: C19H18Cl2N3O2+ MolecularWeight: 391.27112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=COC3=C(C=C(C=C3C2=O)Cl)Cl)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CN(CCN1CC2=COC3=C(C=C(C=C3C2=O)Cl)Cl)C4=CC=CC=[NH+]4

InChI

InChI=1S/C19H17Cl2N3O2/c20-14-9-15-18(25)13(12-26-19(15)16(21)10-14)11-23-5-7-24(8-6-23)17-3-1-2-4-22-17/h1-4,9-10,12H,5-8,11H2/p+1