2-azanyl-3-(3-oxidanylidene-7,8-dihydro-6H-cyclohepta[d][1,2]oxazol-4-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(3-oxidanylidene-7,8-dihydro-6H-cyclohepta[d][1,2]oxazol-4-yl)propanoic acid Openeye Name: 2-amino-3-(3-oxo-7,8-dihydro-6H-cyclohepta[d]isoxazol-4-yl)propanoic acid CAS Name: 2-amino-3-(3-oxo-7,8-dihydro-6H-cyclohepta[d]isoxazol-4-yl)propanoic acid IUPAC Name: 2-amino-3-(3-oxo-7,8-dihydro-6H-cyclohepta[d][1,2]oxazol-4-yl)propanoic acid Traditional Name: 2-amino-3-(3-keto-7,8-dihydro-6H-cyclohept[d]isoxazol-4-yl)propionic acid Formula: C11H14N2O4 MolecularWeight: 238.23986

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C2=C(C1)ONC2=O)CC(C(=O)O)N

Isomeric SMILES

C1CC=C(C2=C(C1)ONC2=O)CC(C(=O)O)N

InChI

InChI=1S/C11H14N2O4/c12-7(11(15)16)5-6-3-1-2-4-8-9(6)10(14)13-17-8/h3,7H,1-2,4-5,12H2,(H,13,14)(H,15,16)