(3E)-3-[(4Z)-4-(5-chloranyl-2-oxidanylidene-1H-indol-3-ylidene)-5-oxidanylidene-pyrazolidin-3-ylidene]-1-methyl-quinoline-2,4-dione

Systemtic Name: (3E)-3-[(4Z)-4-(5-chloranyl-2-oxidanylidene-1H-indol-3-ylidene)-5-oxidanylidene-pyrazolidin-3-ylidene]-1-methyl-quinoline-2,4-dione Openeye Name: (3E)-3-[(4Z)-4-(5-chloro-2-oxo-indolin-3-ylidene)-5-oxo-pyrazolidin-3-ylidene]-1-methyl-quinoline-2,4-dione CAS Name: (3E)-3-[(4Z)-4-(5-chloro-2-oxo-1H-indol-3-ylidene)-5-oxo-3-pyrazolidinylidene]-1-methylquinoline-2,4-dione IUPAC Name: (3E)-3-[(4Z)-4-(5-chloro-2-oxo-1H-indol-3-ylidene)-5-oxopyrazolidin-3-ylidene]-1-methylquinoline-2,4-dione Traditional Name: (3E)-3-[(4Z)-4-(5-chloro-2-keto-indolin-3-ylidene)-5-keto-pyrazolidin-3-ylidene]-1-methyl-quinoline-2,4-quinone Formula: C21H13ClN4O4 MolecularWeight: 420.80532

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(=C3C(=C4C5=C(C=CC(=C5)Cl)NC4=O)C(=O)NN3)C1=O

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)/C(=C\3/C(=C/4\C5=C(C=CC(=C5)Cl)NC4=O)/C(=O)NN3)/C1=O

InChI

InChI=1S/C21H13ClN4O4/c1-26-13-5-3-2-4-10(13)18(27)16(21(26)30)17-15(20(29)25-24-17)14-11-8-9(22)6-7-12(11)23-19(14)28/h2-8,24H,1H3,(H,23,28)(H,25,29)/b15-14-,17-16+