1-(1,3-benzodioxol-5-yl)-3-chloranyl-4-[3-ethyl-1-(4-methoxyphenyl)-5-oxidanylidene-4H-pyrazol-4-yl]pyrrole-2,5-dione

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-chloranyl-4-[3-ethyl-1-(4-methoxyphenyl)-5-oxidanylidene-4H-pyrazol-4-yl]pyrrole-2,5-dione Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-chloro-4-[3-ethyl-1-(4-methoxyphenyl)-5-oxo-4H-pyrazol-4-yl]pyrrole-2,5-dione CAS Name: 1-(1,3-benzodioxol-5-yl)-3-chloro-4-[3-ethyl-1-(4-methoxyphenyl)-5-oxo-4H-pyrazol-4-yl]pyrrole-2,5-dione IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-chloro-4-[3-ethyl-1-(4-methoxyphenyl)-5-oxo-4H-pyrazol-4-yl]pyrrole-2,5-dione Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-chloro-4-[3-ethyl-5-keto-1-(4-methoxyphenyl)-2-pyrazolin-4-yl]-3-pyrroline-2,5-quinone Formula: C23H18ClN3O6 MolecularWeight: 467.85852

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)C1C2=C(C(=O)N(C2=O)C3=CC4=C(C=C3)OCO4)Cl)C5=CC=C(C=C5)OC

Isomeric SMILES

CCC1=NN(C(=O)C1C2=C(C(=O)N(C2=O)C3=CC4=C(C=C3)OCO4)Cl)C5=CC=C(C=C5)OC

InChI

InChI=1S/C23H18ClN3O6/c1-3-15-18(22(29)27(25-15)12-4-7-14(31-2)8-5-12)19-20(24)23(30)26(21(19)28)13-6-9-16-17(10-13)33-11-32-16/h4-10,18H,3,11H2,1-2H3