3-[2-(3,4-dichlorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-4-(3-ethylpyridin-1-ium-1-yl)-1-propyl-pyrrole-2,5-dione

Systemtic Name: 3-[2-(3,4-dichlorophenyl)-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl]-4-(3-ethylpyridin-1-ium-1-yl)-1-propyl-pyrrole-2,5-dione Openeye Name: 3-[2-(3,4-dichlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-4-(3-ethylpyridin-1-ium-1-yl)-1-propyl-pyrrole-2,5-dione CAS Name: 3-[2-(3,4-dichlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-4-(3-ethyl-1-pyridin-1-iumyl)-1-propylpyrrole-2,5-dione IUPAC Name: 3-[2-(3,4-dichlorophenyl)-5-methyl-3-oxo-1H-pyrazol-4-yl]-4-(3-ethylpyridin-1-ium-1-yl)-1-propylpyrrole-2,5-dione Traditional Name: 3-[1-(3,4-dichlorophenyl)-5-keto-3-methyl-3-pyrazolin-4-yl]-4-(3-ethylpyridin-1-ium-1-yl)-1-propyl-3-pyrroline-2,5-quinone Formula: C24H23Cl2N4O3+ MolecularWeight: 486.37042

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C(=C(C1=O)[N+]2=CC=CC(=C2)CC)C3=C(NN(C3=O)C4=CC(=C(C=C4)Cl)Cl)C

Isomeric SMILES

CCCN1C(=O)C(=C(C1=O)[N+]2=CC=CC(=C2)CC)C3=C(NN(C3=O)C4=CC(=C(C=C4)Cl)Cl)C

InChI

InChI=1S/C24H22Cl2N4O3/c1-4-10-29-22(31)20(21(24(29)33)28-11-6-7-15(5-2)13-28)19-14(3)27-30(23(19)32)16-8-9-17(25)18(26)12-16/h6-9,11-13H,4-5,10H2,1-3H3/p+1