(4-butoxycarbonyl-2,5-dimethyl-3-oxidanyl-phenyl) 3,6-dimethyl-2-oxidanyl-4-phenylmethoxy-benzoate

Systemtic Name: (4-butoxycarbonyl-2,5-dimethyl-3-oxidanyl-phenyl) 3,6-dimethyl-2-oxidanyl-4-phenylmethoxy-benzoate Openeye Name: (4-butoxycarbonyl-3-hydroxy-2,5-dimethyl-phenyl) 4-benzyloxy-2-hydroxy-3,6-dimethyl-benzoate CAS Name: 2-hydroxy-3,6-dimethyl-4-phenylmethoxybenzoic acid [4-[butoxy(oxo)methyl]-3-hydroxy-2,5-dimethylphenyl] ester IUPAC Name: (4-butoxycarbonyl-3-hydroxy-2,5-dimethylphenyl) 2-hydroxy-3,6-dimethyl-4-phenylmethoxybenzoate Traditional Name: 4-benzoxy-2-hydroxy-3,6-dimethyl-benzoic acid (4-butoxycarbonyl-3-hydroxy-2,5-dimethyl-phenyl) ester Formula: C29H32O7 MolecularWeight: 492.56018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C(=C(C=C1C)OC(=O)C2=C(C(=C(C=C2C)OCC3=CC=CC=C3)C)O)C)O

Isomeric SMILES

CCCCOC(=O)C1=C(C(=C(C=C1C)OC(=O)C2=C(C(=C(C=C2C)OCC3=CC=CC=C3)C)O)C)O

InChI

InChI=1S/C29H32O7/c1-6-7-13-34-28(32)24-18(3)15-23(20(5)27(24)31)36-29(33)25-17(2)14-22(19(4)26(25)30)35-16-21-11-9-8-10-12-21/h8-12,14-15,30-31H,6-7,13,16H2,1-5H3