sodium 3-[5-(acetamidomethyl)-4,5-dihydro-1,2-oxazol-3-yl]propanoate

Systemtic Name: sodium 3-[5-(acetamidomethyl)-4,5-dihydro-1,2-oxazol-3-yl]propanoate Openeye Name: sodium 3-[5-(acetamidomethyl)-4,5-dihydroisoxazol-3-yl]propanoate CAS Name: sodium 3-[5-(acetamidomethyl)-4,5-dihydroisoxazol-3-yl]propanoate IUPAC Name: sodium 3-[5-(acetamidomethyl)-4,5-dihydro-1,2-oxazol-3-yl]propanoate Traditional Name: sodium 3-[5-(acetamidomethyl)-2-isoxazolin-3-yl]propionate Formula: C9H13N2NaO4 MolecularWeight: 236.20029

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1CC(=NO1)CCC(=O)[O-].[Na+]

Isomeric SMILES

CC(=O)NCC1CC(=NO1)CCC(=O)[O-].[Na+]

InChI

InChI=1S/C9H14N2O4.Na/c1-6(12)10-5-8-4-7(11-15-8)2-3-9(13)14;/h8H,2-5H2,1H3,(H,10,12)(H,13,14);/q;+1/p-1