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

Systemtic Name: 2-[6-oxidanylidene-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]-2-pyridin-3-yl-ethanoic acid Openeye Name: 2-[5-(benzyloxycarbonylamino)-6-oxo-pyrimidin-1-yl]-2-(3-pyridyl)acetic acid CAS Name: 2-[6-oxo-5-(phenylmethoxycarbonylamino)-1-pyrimidinyl]-2-(3-pyridinyl)acetic acid IUPAC Name: 2-[6-oxo-5-(phenylmethoxycarbonylamino)pyrimidin-1-yl]-2-pyridin-3-ylacetic acid Traditional Name: 2-[5-(benzyloxycarbonylamino)-6-keto-pyrimidin-1-yl]-2-(3-pyridyl)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=CN(C2=O)C(C3=CN=CC=C3)C(=O)O

Isomeric SMILES

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

InChI

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