3-(2-azanyl-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl)propanoate

Systemtic Name: 3-(2-azanyl-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl)propanoate Openeye Name: 3-(2-amino-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propanoate CAS Name: 3-(2-amino-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propanoate IUPAC Name: 3-(2-amino-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propanoate Traditional Name: 3-(2-amino-4-keto-6-phenyl-1H-pyrimidin-5-yl)propionate Formula: C13H12N3O3- MolecularWeight: 258.25268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)N)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)N)CCC(=O)[O-]

InChI

InChI=1S/C13H13N3O3/c14-13-15-11(8-4-2-1-3-5-8)9(12(19)16-13)6-7-10(17)18/h1-5H,6-7H2,(H,17,18)(H3,14,15,16,19)/p-1