2-methyl-4-(3-methylbutyl)-1,3,5-tris(oxidanyl)anthracene-9,10-dione

Systemtic Name: 2-methyl-4-(3-methylbutyl)-1,3,5-tris(oxidanyl)anthracene-9,10-dione Openeye Name: 1,3,5-trihydroxy-4-isopentyl-2-methyl-anthracene-9,10-dione CAS Name: 1,3,5-trihydroxy-2-methyl-4-(3-methylbutyl)anthracene-9,10-dione IUPAC Name: 1,3,5-trihydroxy-2-methyl-4-(3-methylbutyl)anthracene-9,10-dione Traditional Name: 1,3,5-trihydroxy-4-isoamyl-2-methyl-9,10-anthraquinone Formula: C20H20O5 MolecularWeight: 340.3698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=C1O)CCC(C)C)C(=O)C3=C(C2=O)C=CC=C3O)O

Isomeric SMILES

CC1=C(C2=C(C(=C1O)CCC(C)C)C(=O)C3=C(C2=O)C=CC=C3O)O

InChI

InChI=1S/C20H20O5/c1-9(2)7-8-12-15-16(18(23)10(3)17(12)22)19(24)11-5-4-6-13(21)14(11)20(15)25/h4-6,9,21-23H,7-8H2,1-3H3