3-chloranyl-4-(3-ethyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)-1-phenyl-pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-(3-ethyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)-1-phenyl-pyrrole-2,5-dione Openeye Name: 3-chloro-4-(3-ethyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)-1-phenyl-pyrrole-2,5-dione CAS Name: 3-chloro-4-(3-ethyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)-1-phenylpyrrole-2,5-dione IUPAC Name: 3-chloro-4-(3-ethyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)-1-phenylpyrrole-2,5-dione Traditional Name: 3-chloro-4-(3-ethyl-5-keto-1-phenyl-2-pyrazolin-4-yl)-1-phenyl-3-pyrroline-2,5-quinone Formula: C21H16ClN3O3 MolecularWeight: 393.82304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=O)C1C2=C(C(=O)N(C2=O)C3=CC=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCC1=NN(C(=O)C1C2=C(C(=O)N(C2=O)C3=CC=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C21H16ClN3O3/c1-2-15-16(20(27)25(23-15)14-11-7-4-8-12-14)17-18(22)21(28)24(19(17)26)13-9-5-3-6-10-13/h3-12,16H,2H2,1H3