2-[6-azanyl-2-oxidanylidene-3-(phenylcarbonyl)-1H-pyrimidin-6-yl]ethanoic acid

Systemtic Name: 2-[6-azanyl-2-oxidanylidene-3-(phenylcarbonyl)-1H-pyrimidin-6-yl]ethanoic acid Openeye Name: 2-(6-amino-3-benzoyl-2-oxo-1H-pyrimidin-6-yl)acetic acid CAS Name: 2-(6-amino-3-benzoyl-2-oxo-1H-pyrimidin-6-yl)acetic acid IUPAC Name: 2-(6-amino-3-benzoyl-2-oxo-1H-pyrimidin-6-yl)acetic acid Traditional Name: 2-(6-amino-3-benzoyl-2-keto-1H-pyrimidin-6-yl)acetic acid Formula: C13H13N3O4 MolecularWeight: 275.26002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)N2C=CC(NC2=O)(CC(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N2C=CC(NC2=O)(CC(=O)O)N

InChI

InChI=1S/C13H13N3O4/c14-13(8-10(17)18)6-7-16(12(20)15-13)11(19)9-4-2-1-3-5-9/h1-7H,8,14H2,(H,15,20)(H,17,18)