2-(3,4-dichlorophenyl)-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-isoindole-1,3-dione

Systemtic Name: 2-(3,4-dichlorophenyl)-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-isoindole-1,3-dione Openeye Name: 2-(3,4-dichlorophenyl)-5-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)isoindoline-1,3-dione CAS Name: 2-(3,4-dichlorophenyl)-5-[oxo-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-(3,4-dichlorophenyl)-5-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)isoindole-1,3-dione Traditional Name: 2-(3,4-dichlorophenyl)-5-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)isoindoline-1,3-quinone Formula: C24H19Cl2N4O3+ MolecularWeight: 482.33866

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC(=C(C=C5)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C(=O)C3=CC4=C(C=C3)C(=O)N(C4=O)C5=CC(=C(C=C5)Cl)Cl

InChI

InChI=1S/C24H18Cl2N4O3/c25-19-7-5-16(14-20(19)26)30-23(32)17-6-4-15(13-18(17)24(30)33)22(31)29-11-9-28(10-12-29)21-3-1-2-8-27-21/h1-8,13-14H,9-12H2/p+1