tert-butyl 4-[2-(hydroxymethyl)-6-phenylmethoxy-phenyl]carbonyl-3,5-bis(phenylmethoxy)benzoate

Systemtic Name: tert-butyl 4-[2-(hydroxymethyl)-6-phenylmethoxy-phenyl]carbonyl-3,5-bis(phenylmethoxy)benzoate Openeye Name: tert-butyl 3,5-dibenzyloxy-4-[2-benzyloxy-6-(hydroxymethyl)benzoyl]benzoate CAS Name: 4-[[2-(hydroxymethyl)-6-phenylmethoxyphenyl]-oxomethyl]-3,5-bis(phenylmethoxy)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(hydroxymethyl)-6-phenylmethoxybenzoyl]-3,5-bis(phenylmethoxy)benzoate Traditional Name: 3,5-dibenzoxy-4-(2-benzoxy-6-methylol-benzoyl)benzoic acid tert-butyl ester Formula: C40H38O7 MolecularWeight: 630.72552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)CO)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)CO)OCC5=CC=CC=C5

InChI

InChI=1S/C40H38O7/c1-40(2,3)47-39(43)32-22-34(45-26-29-16-9-5-10-17-29)37(35(23-32)46-27-30-18-11-6-12-19-30)38(42)36-31(24-41)20-13-21-33(36)44-25-28-14-7-4-8-15-28/h4-23,41H,24-27H2,1-3H3