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

Systemtic Name: 9-(5-bromanyl-2-phenylmethoxy-phenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione Openeye Name: 9-(2-benzyloxy-5-bromo-phenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione CAS Name: 9-(5-bromo-2-phenylmethoxyphenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione IUPAC Name: 9-(5-bromo-2-phenylmethoxyphenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione Traditional Name: 9-(2-benzoxy-5-bromo-phenyl)-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-quinone Formula: C30H31BrO4 MolecularWeight: 535.46874

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=C(C=CC(=C4)Br)OCC5=CC=CC=C5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=C(C=CC(=C4)Br)OCC5=CC=CC=C5)C(=O)C1)C

InChI

InChI=1S/C30H31BrO4/c1-29(2)13-21(32)27-24(15-29)35-25-16-30(3,4)14-22(33)28(25)26(27)20-12-19(31)10-11-23(20)34-17-18-8-6-5-7-9-18/h5-12,26H,13-17H2,1-4H3