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

Systemtic Name: [2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 3,5-ditert-butylbenzoate Openeye Name: [2-(3,4-dimethylanilino)-2-oxo-ethyl] 3,5-ditert-butylbenzoate CAS Name: 3,5-ditert-butylbenzoic acid [2-(3,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylanilino)-2-oxoethyl] 3,5-ditert-butylbenzoate Traditional Name: 3,5-ditert-butylbenzoic acid [2-(3,4-dimethylanilino)-2-keto-ethyl] ester Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)C

InChI

InChI=1S/C25H33NO3/c1-16-9-10-21(11-17(16)2)26-22(27)15-29-23(28)18-12-19(24(3,4)5)14-20(13-18)25(6,7)8/h9-14H,15H2,1-8H3,(H,26,27)