methyl (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)-(3-oxidanylidenebutanoyl)amino]propanoate

Systemtic Name: methyl (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)-(3-oxidanylidenebutanoyl)amino]propanoate Openeye Name: methyl (2S)-2-[(3,5-dimethylisoxazol-4-yl)-(3-oxobutanoyl)amino]propanoate CAS Name: (2S)-2-[(3,5-dimethyl-4-isoxazolyl)-(1,3-dioxobutyl)amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)-(3-oxobutanoyl)amino]propanoate Traditional Name: (2S)-2-[acetoacetyl-(3,5-dimethylisoxazol-4-yl)amino]propionic acid methyl ester Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)N(C(C)C(=O)OC)C(=O)CC(=O)C

Isomeric SMILES

CC1=C(C(=NO1)C)N([C@@H](C)C(=O)OC)C(=O)CC(=O)C

InChI

InChI=1S/C13H18N2O5/c1-7(16)6-11(17)15(9(3)13(18)19-5)12-8(2)14-20-10(12)4/h9H,6H2,1-5H3/t9-/m0/s1