2-[6-oxidanylidene-5-(phenylmethoxycarbonylamino)-2-pyridin-3-yl-pyrimidin-1-yl]ethanoic acid

Systemtic Name: 2-[6-oxidanylidene-5-(phenylmethoxycarbonylamino)-2-pyridin-3-yl-pyrimidin-1-yl]ethanoic acid Openeye Name: 2-[5-(benzyloxycarbonylamino)-6-oxo-2-(3-pyridyl)pyrimidin-1-yl]acetic acid CAS Name: 2-[6-oxo-5-(phenylmethoxycarbonylamino)-2-(3-pyridinyl)-1-pyrimidinyl]acetic acid IUPAC Name: 2-[6-oxo-5-(phenylmethoxycarbonylamino)-2-pyridin-3-ylpyrimidin-1-yl]acetic acid Traditional Name: 2-[5-(benzyloxycarbonylamino)-6-keto-2-(3-pyridyl)pyrimidin-1-yl]acetic acid Formula: C19H16N4O5 MolecularWeight: 380.35414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16N4O5/c24-16(25)11-23-17(14-7-4-8-20-9-14)21-10-15(18(23)26)22-19(27)28-12-13-5-2-1-3-6-13/h1-10H,11-12H2,(H,22,27)(H,24,25)