(2S)-2-(methylazaniumyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butanoate

Systemtic Name: (2S)-2-(methylazaniumyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxidanylidene-butanoate Openeye Name: (2S)-4-tert-butoxy-2-(methylammonio)-4-oxo-butanoate CAS Name: (2S)-2-(methylammonio)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate IUPAC Name: (2S)-2-(methylazaniumyl)-4-[(2-methylpropan-2-yl)oxy]-4-oxobutanoate Traditional Name: (2S)-4-tert-butoxy-4-keto-2-(methylammonio)butyrate Formula: C9H17NO4 MolecularWeight: 203.23558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC(C(=O)[O-])[NH2+]C

Isomeric SMILES

CC(C)(C)OC(=O)C[C@@H](C(=O)[O-])[NH2+]C

InChI

InChI=1S/C9H17NO4/c1-9(2,3)14-7(11)5-6(10-4)8(12)13/h6,10H,5H2,1-4H3,(H,12,13)/t6-/m0/s1