methyl 2,3-dimethyl-5-[2,2,2-tris(3-methoxycarbonyl-4,5-dimethyl-phenyl)ethyl]benzoate

Systemtic Name: methyl 2,3-dimethyl-5-[2,2,2-tris(3-methoxycarbonyl-4,5-dimethyl-phenyl)ethyl]benzoate Openeye Name: methyl 2,3-dimethyl-5-[2,2,2-tris(3-methoxycarbonyl-4,5-dimethyl-phenyl)ethyl]benzoate CAS Name: 2,3-dimethyl-5-[2,2,2-tris(3-methoxycarbonyl-4,5-dimethylphenyl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 2,3-dimethyl-5-[2,2,2-tris(3-methoxycarbonyl-4,5-dimethylphenyl)ethyl]benzoate Traditional Name: 2,3-dimethyl-5-[2,2,2-tris(3-carbomethoxy-4,5-dimethyl-phenyl)ethyl]benzoic acid methyl ester Formula: C42H46O8 MolecularWeight: 678.80984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)CC(C2=CC(=C(C(=C2)C(=O)OC)C)C)(C3=CC(=C(C(=C3)C(=O)OC)C)C)C4=CC(=C(C(=C4)C(=O)OC)C)C)C(=O)OC)C

Isomeric SMILES

CC1=C(C(=CC(=C1)CC(C2=CC(=C(C(=C2)C(=O)OC)C)C)(C3=CC(=C(C(=C3)C(=O)OC)C)C)C4=CC(=C(C(=C4)C(=O)OC)C)C)C(=O)OC)C

InChI

InChI=1S/C42H46O8/c1-22-13-30(17-34(26(22)5)38(43)47-9)21-42(31-14-23(2)27(6)35(18-31)39(44)48-10,32-15-24(3)28(7)36(19-32)40(45)49-11)33-16-25(4)29(8)37(20-33)41(46)50-12/h13-20H,21H2,1-12H3