[2-(3,4-dimethylphenyl)-2-oxidanylidene-1-phenyl-ethyl] 3,5-ditert-butylbenzoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-1-phenyl-ethyl] 3,5-ditert-butylbenzoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-1-phenyl-ethyl] 3,5-ditert-butylbenzoate CAS Name: 3,5-ditert-butylbenzoic acid [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxo-1-phenylethyl] 3,5-ditert-butylbenzoate Traditional Name: 3,5-ditert-butylbenzoic acid [2-(3,4-dimethylphenyl)-2-keto-1-phenyl-ethyl] ester Formula: C31H36O3 MolecularWeight: 456.61574

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H36O3/c1-20-14-15-23(16-21(20)2)27(32)28(22-12-10-9-11-13-22)34-29(33)24-17-25(30(3,4)5)19-26(18-24)31(6,7)8/h9-19,28H,1-8H3