(3,3-dimethyl-2-oxidanylidene-butyl) 2-(2-phenylethanoylamino)benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-(2-phenylethanoylamino)benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[(2-phenylacetyl)amino]benzoate CAS Name: 2-[(1-oxo-2-phenylethyl)amino]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[(2-phenylacetyl)amino]benzoate Traditional Name: 2-[(2-phenylacetyl)amino]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NC(=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)COC(=O)C1=CC=CC=C1NC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C21H23NO4/c1-21(2,3)18(23)14-26-20(25)16-11-7-8-12-17(16)22-19(24)13-15-9-5-4-6-10-15/h4-12H,13-14H2,1-3H3,(H,22,24)