2,7-ditert-butyl-5-methanoyl-9,9-dimethyl-xanthene-4-carboxylic acid

Systemtic Name: 2,7-ditert-butyl-5-methanoyl-9,9-dimethyl-xanthene-4-carboxylic acid Openeye Name: 2,7-ditert-butyl-5-formyl-9,9-dimethyl-xanthene-4-carboxylic acid CAS Name: 2,7-ditert-butyl-5-formyl-9,9-dimethyl-4-xanthenecarboxylic acid IUPAC Name: 2,7-ditert-butyl-5-formyl-9,9-dimethylxanthene-4-carboxylic acid Traditional Name: 2,7-ditert-butyl-5-formyl-9,9-dimethyl-xanthene-4-carboxylic acid Formula: C25H30O4 MolecularWeight: 394.5033

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=CC(=C2)C(C)(C)C)C=O)OC3=C1C=C(C=C3C(=O)O)C(C)(C)C)C

Isomeric SMILES

CC1(C2=C(C(=CC(=C2)C(C)(C)C)C=O)OC3=C1C=C(C=C3C(=O)O)C(C)(C)C)C

InChI

InChI=1S/C25H30O4/c1-23(2,3)15-9-14(13-26)20-18(11-15)25(7,8)19-12-16(24(4,5)6)10-17(22(27)28)21(19)29-20/h9-13H,1-8H3,(H,27,28)