3,6-bis(2,4,4-trimethylpentan-2-yl)-9H-xanthene-2,7-diol

Systemtic Name: 3,6-bis(2,4,4-trimethylpentan-2-yl)-9H-xanthene-2,7-diol Openeye Name: 3,6-bis(1,1,3,3-tetramethylbutyl)-9H-xanthene-2,7-diol CAS Name: 3,6-bis(2,4,4-trimethylpentan-2-yl)-9H-xanthene-2,7-diol IUPAC Name: 3,6-bis(2,4,4-trimethylpentan-2-yl)-9H-xanthene-2,7-diol Traditional Name: 3,6-bis(1,1,3,3-tetramethylbutyl)-9H-xanthene-2,7-diol Formula: C29H42O3 MolecularWeight: 438.64198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(C)(C)C1=C(C=C2CC3=CC(=C(C=C3OC2=C1)C(C)(C)CC(C)(C)C)O)O

Isomeric SMILES

CC(C)(C)CC(C)(C)C1=C(C=C2CC3=CC(=C(C=C3OC2=C1)C(C)(C)CC(C)(C)C)O)O

InChI

InChI=1S/C29H42O3/c1-26(2,3)16-28(7,8)20-14-24-18(12-22(20)30)11-19-13-23(31)21(15-25(19)32-24)29(9,10)17-27(4,5)6/h12-15,30-31H,11,16-17H2,1-10H3