2-[6-oxidanylidene-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[6-oxidanylidene-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]-2-phenyl-ethanoic acid Openeye Name: 2-[5-(benzyloxycarbonylamino)-6-oxo-pyrimidin-1-yl]-2-phenyl-acetic acid CAS Name: 2-[6-oxo-5-(phenylmethoxycarbonylamino)-1-pyrimidinyl]-2-phenylacetic acid IUPAC Name: 2-[6-oxo-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]-2-phenylacetic acid Traditional Name: 2-[5-(benzyloxycarbonylamino)-6-keto-pyrimidin-1-yl]-2-phenyl-acetic acid Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=CN=CN(C2=O)C(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=CN=CN(C2=O)C(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H17N3O5/c24-18-16(22-20(27)28-12-14-7-3-1-4-8-14)11-21-13-23(18)17(19(25)26)15-9-5-2-6-10-15/h1-11,13,17H,12H2,(H,22,27)(H,25,26)