2-(2-azanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-3-oxidanylidene-3-phenylmethoxy-propanoic acid

Systemtic Name: 2-(2-azanyl-6-oxidanylidene-1H-pyrimidin-5-yl)-3-oxidanylidene-3-phenylmethoxy-propanoic acid Openeye Name: 2-(2-amino-6-oxo-1H-pyrimidin-5-yl)-3-benzyloxy-3-oxo-propanoic acid CAS Name: 2-(2-amino-6-oxo-1H-pyrimidin-5-yl)-3-oxo-3-phenylmethoxypropanoic acid IUPAC Name: 2-(2-amino-6-oxo-1H-pyrimidin-5-yl)-3-oxo-3-phenylmethoxypropanoic acid Traditional Name: 2-(2-amino-6-keto-1H-pyrimidin-5-yl)-3-benzoxy-3-keto-propionic acid Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O5/c15-14-16-6-9(11(18)17-14)10(12(19)20)13(21)22-7-8-4-2-1-3-5-8/h1-6,10H,7H2,(H,19,20)(H3,15,16,17,18)