(phenylmethyl) 2,7-ditert-butyl-5-(3-methanoyl-4-oxidanyl-phenyl)-9,9-dimethyl-xanthene-4-carboxylate

Systemtic Name: (phenylmethyl) 2,7-ditert-butyl-5-(3-methanoyl-4-oxidanyl-phenyl)-9,9-dimethyl-xanthene-4-carboxylate Openeye Name: benzyl 2,7-ditert-butyl-5-(3-formyl-4-hydroxy-phenyl)-9,9-dimethyl-xanthene-4-carboxylate CAS Name: 2,7-ditert-butyl-5-(3-formyl-4-hydroxyphenyl)-9,9-dimethyl-4-xanthenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2,7-ditert-butyl-5-(3-formyl-4-hydroxyphenyl)-9,9-dimethylxanthene-4-carboxylate Traditional Name: 2,7-ditert-butyl-5-(3-formyl-4-hydroxy-phenyl)-9,9-dimethyl-xanthene-4-carboxylic acid benzyl ester Formula: C38H40O5 MolecularWeight: 576.7212

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C(=CC(=C2)C(C)(C)C)C3=CC(=C(C=C3)O)C=O)OC4=C1C=C(C=C4C(=O)OCC5=CC=CC=C5)C(C)(C)C)C

Isomeric SMILES

CC1(C2=C(C(=CC(=C2)C(C)(C)C)C3=CC(=C(C=C3)O)C=O)OC4=C1C=C(C=C4C(=O)OCC5=CC=CC=C5)C(C)(C)C)C

InChI

InChI=1S/C38H40O5/c1-36(2,3)26-17-28(24-14-15-32(40)25(16-24)21-39)33-30(19-26)38(7,8)31-20-27(37(4,5)6)18-29(34(31)43-33)35(41)42-22-23-12-10-9-11-13-23/h9-21,40H,22H2,1-8H3