3-[3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,2-oxazolidin-5-yl]propanoic acid

Systemtic Name: 3-[3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1,2-oxazolidin-5-yl]propanoic acid Openeye Name: 3-[3-(4-oxocyclohexa-2,5-dien-1-ylidene)isoxazolidin-5-yl]propanoic acid CAS Name: 3-[3-(4-oxo-1-cyclohexa-2,5-dienylidene)-5-isoxazolidinyl]propanoic acid IUPAC Name: 3-[3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1,2-oxazolidin-5-yl]propanoic acid Traditional Name: 3-[3-(4-ketocyclohexa-2,5-dien-1-ylidene)isoxazolidin-5-yl]propionic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ONC1=C2C=CC(=O)C=C2)CCC(=O)O

Isomeric SMILES

C1C(ONC1=C2C=CC(=O)C=C2)CCC(=O)O

InChI

InChI=1S/C12H13NO4/c14-9-3-1-8(2-4-9)11-7-10(17-13-11)5-6-12(15)16/h1-4,10,13H,5-7H2,(H,15,16)