phenylmethoxycarbonylamino 2-oxidanylidenebutanoate

Systemtic Name: phenylmethoxycarbonylamino 2-oxidanylidenebutanoate Openeye Name: benzyloxycarbonylamino 2-oxobutanoate CAS Name: 2-oxobutanoic acid phenylmethoxycarbonylamino ester IUPAC Name: phenylmethoxycarbonylamino 2-oxobutanoate Traditional Name: 2-ketobutyric acid benzyloxycarbonylamino ester Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(=O)ONC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCC(=O)C(=O)ONC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C12H13NO5/c1-2-10(14)11(15)18-13-12(16)17-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H,13,16)