1-(4-chlorophenyl)-3-(4-ethylpiperazin-4-ium-1-yl)pyrrole-2,5-dione

Systemtic Name: 1-(4-chlorophenyl)-3-(4-ethylpiperazin-4-ium-1-yl)pyrrole-2,5-dione Openeye Name: 1-(4-chlorophenyl)-3-(4-ethylpiperazin-4-ium-1-yl)pyrrole-2,5-dione CAS Name: 1-(4-chlorophenyl)-3-(4-ethyl-1-piperazin-4-iumyl)pyrrole-2,5-dione IUPAC Name: 1-(4-chlorophenyl)-3-(4-ethylpiperazin-4-ium-1-yl)pyrrole-2,5-dione Traditional Name: 1-(4-chlorophenyl)-3-(4-ethylpiperazin-4-ium-1-yl)-3-pyrroline-2,5-quinone Formula: C16H19ClN3O2+ MolecularWeight: 320.79396

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC(=O)N(C2=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC(=O)N(C2=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN3O2/c1-2-18-7-9-19(10-8-18)14-11-15(21)20(16(14)22)13-5-3-12(17)4-6-13/h3-6,11H,2,7-10H2,1H3/p+1