2-(5-chloranyl-2-oxidanyl-phenyl)-6-ethanoyl-benzo[de]isoquinoline-1,3-dione

Systemtic Name: 2-(5-chloranyl-2-oxidanyl-phenyl)-6-ethanoyl-benzo[de]isoquinoline-1,3-dione Openeye Name: 6-acetyl-2-(5-chloro-2-hydroxy-phenyl)benzo[de]isoquinoline-1,3-dione CAS Name: 6-acetyl-2-(5-chloro-2-hydroxyphenyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-acetyl-2-(5-chloro-2-hydroxyphenyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-acetyl-2-(5-chloro-2-hydroxy-phenyl)benzo[de]isoquinoline-1,3-quinone Formula: C20H12ClNO4 MolecularWeight: 365.76658

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)C4=C(C=CC(=C4)Cl)O

Isomeric SMILES

CC(=O)C1=C2C=CC=C3C2=C(C=C1)C(=O)N(C3=O)C4=C(C=CC(=C4)Cl)O

InChI

InChI=1S/C20H12ClNO4/c1-10(23)12-6-7-15-18-13(12)3-2-4-14(18)19(25)22(20(15)26)16-9-11(21)5-8-17(16)24/h2-9,24H,1H3