(3,3-dimethyl-2-oxidanylidene-butyl) 2-[(3-methylphenyl)carbonylamino]ethanoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 2-[(3-methylphenyl)carbonylamino]ethanoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 2-[(3-methylbenzoyl)amino]acetate CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]acetic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 2-[(3-methylbenzoyl)amino]acetate Traditional Name: 2-(m-toluoylamino)acetic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C16H21NO4/c1-11-6-5-7-12(8-11)15(20)17-9-14(19)21-10-13(18)16(2,3)4/h5-8H,9-10H2,1-4H3,(H,17,20)