1-chloranyl-2-(4-methyl-3-oxidanyl-pent-1-ynyl)anthracene-9,10-dione

Systemtic Name: 1-chloranyl-2-(4-methyl-3-oxidanyl-pent-1-ynyl)anthracene-9,10-dione Openeye Name: 1-chloro-2-(3-hydroxy-4-methyl-pent-1-ynyl)anthracene-9,10-dione CAS Name: 1-chloro-2-(3-hydroxy-4-methylpent-1-ynyl)anthracene-9,10-dione IUPAC Name: 1-chloro-2-(3-hydroxy-4-methylpent-1-ynyl)anthracene-9,10-dione Traditional Name: 1-chloro-2-(3-hydroxy-4-methyl-pent-1-ynyl)-9,10-anthraquinone Formula: C20H15ClO3 MolecularWeight: 338.7843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15ClO3/c1-11(2)16(22)10-8-12-7-9-15-17(18(12)21)20(24)14-6-4-3-5-13(14)19(15)23/h3-7,9,11,16,22H,1-2H3