4-[6,7-bis(chloranyl)-1-oxidanylidene-2-phenyl-2-prop-2-ynyl-3H-inden-5-yl]-5-oxidanyl-1H-pyrrole-2,3-dione

Systemtic Name: 4-[6,7-bis(chloranyl)-1-oxidanylidene-2-phenyl-2-prop-2-ynyl-3H-inden-5-yl]-5-oxidanyl-1H-pyrrole-2,3-dione Openeye Name: 4-(6,7-dichloro-1-oxo-2-phenyl-2-prop-2-ynyl-indan-5-yl)-5-hydroxy-1H-pyrrole-2,3-dione CAS Name: 4-(6,7-dichloro-1-oxo-2-phenyl-2-prop-2-ynyl-3H-inden-5-yl)-5-hydroxy-1H-pyrrole-2,3-dione IUPAC Name: 4-(6,7-dichloro-1-oxo-2-phenyl-2-prop-2-ynyl-3H-inden-5-yl)-5-hydroxy-1H-pyrrole-2,3-dione Traditional Name: 4-(6,7-dichloro-1-keto-2-phenyl-2-propargyl-indan-5-yl)-5-hydroxy-2-pyrroline-2,3-quinone Formula: C22H13Cl2NO4 MolecularWeight: 426.24892

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC1(CC2=C(C1=O)C(=C(C(=C2)C3=C(NC(=O)C3=O)O)Cl)Cl)C4=CC=CC=C4

Isomeric SMILES

C#CCC1(CC2=C(C1=O)C(=C(C(=C2)C3=C(NC(=O)C3=O)O)Cl)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H13Cl2NO4/c1-2-8-22(12-6-4-3-5-7-12)10-11-9-13(15-18(26)21(29)25-20(15)28)16(23)17(24)14(11)19(22)27/h1,3-7,9H,8,10H2,(H2,25,26,28,29)