2,7-ditert-butyl-5-(5,5-dimethyl-1,3-dioxan-2-yl)-9,9-dimethyl-xanthene-4-carboxylic acid

Systemtic Name: 2,7-ditert-butyl-5-(5,5-dimethyl-1,3-dioxan-2-yl)-9,9-dimethyl-xanthene-4-carboxylic acid Openeye Name: 2,7-ditert-butyl-5-(5,5-dimethyl-1,3-dioxan-2-yl)-9,9-dimethyl-xanthene-4-carboxylic acid CAS Name: 2,7-ditert-butyl-5-(5,5-dimethyl-1,3-dioxan-2-yl)-9,9-dimethyl-4-xanthenecarboxylic acid IUPAC Name: 2,7-ditert-butyl-5-(5,5-dimethyl-1,3-dioxan-2-yl)-9,9-dimethylxanthene-4-carboxylic acid Traditional Name: 2,7-ditert-butyl-5-(5,5-dimethyl-1,3-dioxan-2-yl)-9,9-dimethyl-xanthene-4-carboxylic acid Formula: C30H40O5 MolecularWeight: 480.6356

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)C2=CC(=CC3=C2OC4=C(C3(C)C)C=C(C=C4C(=O)O)C(C)(C)C)C(C)(C)C)C

Isomeric SMILES

CC1(COC(OC1)C2=CC(=CC3=C2OC4=C(C3(C)C)C=C(C=C4C(=O)O)C(C)(C)C)C(C)(C)C)C

InChI

InChI=1S/C30H40O5/c1-27(2,3)17-11-19(25(31)32)23-21(13-17)30(9,10)22-14-18(28(4,5)6)12-20(24(22)35-23)26-33-15-29(7,8)16-34-26/h11-14,26H,15-16H2,1-10H3,(H,31,32)