5-chloranyl-7-methyl-7-oxidanyl-3-phenyl-isochromene-6,8-dione

Systemtic Name: 5-chloranyl-7-methyl-7-oxidanyl-3-phenyl-isochromene-6,8-dione Openeye Name: 5-chloro-7-hydroxy-7-methyl-3-phenyl-isochromene-6,8-dione CAS Name: 5-chloro-7-hydroxy-7-methyl-3-phenyl-2-benzopyran-6,8-dione IUPAC Name: 5-chloro-7-hydroxy-7-methyl-3-phenylisochromene-6,8-dione Traditional Name: 5-chloro-7-hydroxy-7-methyl-3-phenyl-isochromene-6,8-quinone Formula: C16H11ClO4 MolecularWeight: 302.70914

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C2=COC(=CC2=C(C1=O)Cl)C3=CC=CC=C3)O

Isomeric SMILES

CC1(C(=O)C2=COC(=CC2=C(C1=O)Cl)C3=CC=CC=C3)O

InChI

InChI=1S/C16H11ClO4/c1-16(20)14(18)11-8-21-12(9-5-3-2-4-6-9)7-10(11)13(17)15(16)19/h2-8,20H,1H3