(3,3-dimethyl-2-oxidanylidene-butyl) (2S)-2-benzamido-3-methyl-butanoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) (2S)-2-benzamido-3-methyl-butanoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) (2S)-2-benzamido-3-methyl-butanoate CAS Name: (2S)-2-benzamido-3-methylbutanoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) (2S)-2-benzamido-3-methylbutanoate Traditional Name: (2S)-2-benzamido-3-methyl-butyric acid (2-keto-3,3-dimethyl-butyl) ester Formula: C18H25NO4 MolecularWeight: 319.3954

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)C(C)(C)C)NC(=O)C1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)C(C)(C)C)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C18H25NO4/c1-12(2)15(17(22)23-11-14(20)18(3,4)5)19-16(21)13-9-7-6-8-10-13/h6-10,12,15H,11H2,1-5H3,(H,19,21)/t15-/m0/s1