(3S)-3-azaniumyl-3-(5-methyl-3-oxidanylidene-1,2-oxazol-4-yl)propanoate

Systemtic Name: (3S)-3-azaniumyl-3-(5-methyl-3-oxidanylidene-1,2-oxazol-4-yl)propanoate Openeye Name: (3S)-3-azaniumyl-3-(5-methyl-3-oxo-isoxazol-4-yl)propanoate CAS Name: (3S)-3-ammonio-3-(5-methyl-3-oxo-4-isoxazolyl)propanoate IUPAC Name: (3S)-3-azaniumyl-3-(5-methyl-3-oxo-1,2-oxazol-4-yl)propanoate Traditional Name: (3S)-3-ammonio-3-(3-keto-5-methyl-4-isoxazolin-4-yl)propionate Formula: C7H10N2O4 MolecularWeight: 186.1653

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NO1)C(CC(=O)[O-])[NH3+]

Isomeric SMILES

CC1=C(C(=O)NO1)[C@H](CC(=O)[O-])[NH3+]

InChI

InChI=1S/C7H10N2O4/c1-3-6(7(12)9-13-3)4(8)2-5(10)11/h4H,2,8H2,1H3,(H,9,12)(H,10,11)/t4-/m0/s1