3,3,6,6-tetramethyl-9-(2-phenoxyphenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione

Systemtic Name: 3,3,6,6-tetramethyl-9-(2-phenoxyphenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione Openeye Name: 3,3,6,6-tetramethyl-9-(2-phenoxyphenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione CAS Name: 3,3,6,6-tetramethyl-9-(2-phenoxyphenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione IUPAC Name: 3,3,6,6-tetramethyl-9-(2-phenoxyphenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione Traditional Name: 3,3,6,6-tetramethyl-9-(2-phenoxyphenyl)-4,5,7,9-tetrahydro-2H-xanthene-1,8-quinone Formula: C29H30O4 MolecularWeight: 442.5461

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC=CC=C4OC5=CC=CC=C5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC=CC=C4OC5=CC=CC=C5)C(=O)C1)C

InChI

InChI=1S/C29H30O4/c1-28(2)14-20(30)26-23(16-28)33-24-17-29(3,4)15-21(31)27(24)25(26)19-12-8-9-13-22(19)32-18-10-6-5-7-11-18/h5-13,25H,14-17H2,1-4H3