2-[6-oxidanyl-4-oxidanylidene-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]ethanoic acid

Systemtic Name: 2-[6-oxidanyl-4-oxidanylidene-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]ethanoic acid Openeye Name: 2-[5-(benzyloxycarbonylamino)-6-hydroxy-4-oxo-pyrimidin-1-yl]acetic acid CAS Name: 2-[6-hydroxy-4-oxo-5-(phenylmethoxycarbonylamino)-1-pyrimidinyl]acetic acid IUPAC Name: 2-[6-hydroxy-4-oxo-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]acetic acid Traditional Name: 2-[5-(benzyloxycarbonylamino)-6-hydroxy-4-keto-pyrimidin-1-yl]acetic acid Formula: C14H13N3O6 MolecularWeight: 319.26952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=C(N(C=NC2=O)CC(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=C(N(C=NC2=O)CC(=O)O)O

InChI

InChI=1S/C14H13N3O6/c18-10(19)6-17-8-15-12(20)11(13(17)21)16-14(22)23-7-9-4-2-1-3-5-9/h1-5,8,21H,6-7H2,(H,16,22)(H,18,19)