2-hexyl-8-methoxy-1-oxidanyl-anthracene-9,10-dione

Systemtic Name: 2-hexyl-8-methoxy-1-oxidanyl-anthracene-9,10-dione Openeye Name: 2-hexyl-1-hydroxy-8-methoxy-anthracene-9,10-dione CAS Name: 2-hexyl-1-hydroxy-8-methoxyanthracene-9,10-dione IUPAC Name: 2-hexyl-1-hydroxy-8-methoxyanthracene-9,10-dione Traditional Name: 2-hexyl-1-hydroxy-8-methoxy-9,10-anthraquinone Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C1)C(=O)C3=C(C2=O)C(=CC=C3)OC)O

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C1)C(=O)C3=C(C2=O)C(=CC=C3)OC)O

InChI

InChI=1S/C21H22O4/c1-3-4-5-6-8-13-11-12-15-18(19(13)22)21(24)17-14(20(15)23)9-7-10-16(17)25-2/h7,9-12,22H,3-6,8H2,1-2H3