2-butan-2-yloxy-1,8,11-tris(oxidanyl)-7,8,9,10-tetrahydrotetracene-5,12-dione

Systemtic Name: 2-butan-2-yloxy-1,8,11-tris(oxidanyl)-7,8,9,10-tetrahydrotetracene-5,12-dione Openeye Name: 1,8,11-trihydroxy-2-sec-butoxy-7,8,9,10-tetrahydrotetracene-5,12-dione CAS Name: 2-butan-2-yloxy-1,8,11-trihydroxy-7,8,9,10-tetrahydrotetracene-5,12-dione IUPAC Name: 2-butan-2-yloxy-1,8,11-trihydroxy-7,8,9,10-tetrahydrotetracene-5,12-dione Traditional Name: 1,8,11-trihydroxy-2-sec-butoxy-7,8,9,10-tetrahydrotetracene-5,12-quinone Formula: C22H22O6 MolecularWeight: 382.40648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=C(C2=C(C=C1)C(=O)C3=CC4=C(CCC(C4)O)C(=C3C2=O)O)O

Isomeric SMILES

CCC(C)OC1=C(C2=C(C=C1)C(=O)C3=CC4=C(CCC(C4)O)C(=C3C2=O)O)O

InChI

InChI=1S/C22H22O6/c1-3-10(2)28-16-7-6-14-17(21(16)26)22(27)18-15(19(14)24)9-11-8-12(23)4-5-13(11)20(18)25/h6-7,9-10,12,23,25-26H,3-5,8H2,1-2H3