methyl 4-[2,7-ditert-butyl-5-(3-methanoyl-4-methoxy-phenyl)-9,9-dimethyl-xanthen-4-yl]benzoate

Systemtic Name: methyl 4-[2,7-ditert-butyl-5-(3-methanoyl-4-methoxy-phenyl)-9,9-dimethyl-xanthen-4-yl]benzoate Openeye Name: methyl 4-[2,7-ditert-butyl-5-(3-formyl-4-methoxy-phenyl)-9,9-dimethyl-xanthen-4-yl]benzoate CAS Name: 4-[2,7-ditert-butyl-5-(3-formyl-4-methoxyphenyl)-9,9-dimethyl-4-xanthenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2,7-ditert-butyl-5-(3-formyl-4-methoxyphenyl)-9,9-dimethylxanthen-4-yl]benzoate Traditional Name: 4-[2,7-ditert-butyl-5-(3-formyl-4-methoxy-phenyl)-9,9-dimethyl-xanthen-4-yl]benzoic acid methyl ester Formula: C39H42O5 MolecularWeight: 590.74778

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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)C(=O)OC)OC4=C1C=C(C=C4C5=CC(=C(C=C5)OC)C=O)C(C)(C)C)C

Isomeric SMILES

CC1(C2=C(C(=CC(=C2)C(C)(C)C)C3=CC=C(C=C3)C(=O)OC)OC4=C1C=C(C=C4C5=CC(=C(C=C5)OC)C=O)C(C)(C)C)C

InChI

InChI=1S/C39H42O5/c1-37(2,3)27-18-29(23-11-13-24(14-12-23)36(41)43-10)34-31(20-27)39(7,8)32-21-28(38(4,5)6)19-30(35(32)44-34)25-15-16-33(42-9)26(17-25)22-40/h11-22H,1-10H3