1-chloranyl-2-(3-methyl-3-oxidanyl-but-1-ynyl)anthracene-9,10-dione

Systemtic Name: 1-chloranyl-2-(3-methyl-3-oxidanyl-but-1-ynyl)anthracene-9,10-dione Openeye Name: 1-chloro-2-(3-hydroxy-3-methyl-but-1-ynyl)anthracene-9,10-dione CAS Name: 1-chloro-2-(3-hydroxy-3-methylbut-1-ynyl)anthracene-9,10-dione IUPAC Name: 1-chloro-2-(3-hydroxy-3-methylbut-1-ynyl)anthracene-9,10-dione Traditional Name: 1-chloro-2-(3-hydroxy-3-methyl-but-1-ynyl)-9,10-anthraquinone Formula: C19H13ClO3 MolecularWeight: 324.75772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)Cl)O

Isomeric SMILES

CC(C)(C#CC1=C(C2=C(C=C1)C(=O)C3=CC=CC=C3C2=O)Cl)O

InChI

InChI=1S/C19H13ClO3/c1-19(2,23)10-9-11-7-8-14-15(16(11)20)18(22)13-6-4-3-5-12(13)17(14)21/h3-8,23H,1-2H3