4-[(5-methyl-3-oxidanylidene-1,2-oxazol-4-yl)methyl]piperazine-2-carboxylic acid

Systemtic Name: 4-[(5-methyl-3-oxidanylidene-1,2-oxazol-4-yl)methyl]piperazine-2-carboxylic acid Openeye Name: 4-[(5-methyl-3-oxo-isoxazol-4-yl)methyl]piperazine-2-carboxylic acid CAS Name: 4-[(5-methyl-3-oxo-4-isoxazolyl)methyl]-2-piperazinecarboxylic acid IUPAC Name: 4-[(5-methyl-3-oxo-1,2-oxazol-4-yl)methyl]piperazine-2-carboxylic acid Traditional Name: 4-[(3-keto-5-methyl-4-isoxazolin-4-yl)methyl]piperazine-2-carboxylic acid Formula: C10H15N3O4 MolecularWeight: 241.2438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NO1)CN2CCNC(C2)C(=O)O

Isomeric SMILES

CC1=C(C(=O)NO1)CN2CCNC(C2)C(=O)O

InChI

InChI=1S/C10H15N3O4/c1-6-7(9(14)12-17-6)4-13-3-2-11-8(5-13)10(15)16/h8,11H,2-5H2,1H3,(H,12,14)(H,15,16)