2-hexan-2-yl-1,8-bis(oxidanyl)-10H-anthracen-9-one

Systemtic Name: 2-hexan-2-yl-1,8-bis(oxidanyl)-10H-anthracen-9-one Openeye Name: 1,8-dihydroxy-2-(1-methylpentyl)-10H-anthracen-9-one CAS Name: 2-hexan-2-yl-1,8-dihydroxy-10H-anthracen-9-one IUPAC Name: 2-hexan-2-yl-1,8-dihydroxy-10H-anthracen-9-one Traditional Name: 1,8-dihydroxy-2-(1-methylpentyl)-10H-anthracen-9-one Formula: C20H22O3 MolecularWeight: 310.38688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)C1=C(C2=C(CC3=C(C2=O)C(=CC=C3)O)C=C1)O

Isomeric SMILES

CCCCC(C)C1=C(C2=C(CC3=C(C2=O)C(=CC=C3)O)C=C1)O

InChI

InChI=1S/C20H22O3/c1-3-4-6-12(2)15-10-9-14-11-13-7-5-8-16(21)17(13)20(23)18(14)19(15)22/h5,7-10,12,21-22H,3-4,6,11H2,1-2H3