[1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 3-acetamidobenzoate

Systemtic Name: [1-oxidanylidene-1-(2,4,5-trimethylphenyl)propan-2-yl] 3-acetamidobenzoate Openeye Name: [1-methyl-2-oxo-2-(2,4,5-trimethylphenyl)ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(2,4,5-trimethylphenyl)propan-2-yl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [2-keto-1-methyl-2-(2,4,5-trimethylphenyl)ethyl] ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C(C)OC(=O)C2=CC(=CC=C2)NC(=O)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)C(C)OC(=O)C2=CC(=CC=C2)NC(=O)C)C)C

InChI

InChI=1S/C21H23NO4/c1-12-9-14(3)19(10-13(12)2)20(24)15(4)26-21(25)17-7-6-8-18(11-17)22-16(5)23/h6-11,15H,1-5H3,(H,22,23)