2-[3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]benzoate

Systemtic Name: 2-[3-(2,6-dimethyl-4-oxidanylidene-1H-pyrimidin-5-yl)propanoylamino]benzoate Openeye Name: 2-[3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]benzoate CAS Name: 2-[[3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)-1-oxopropyl]amino]benzoate IUPAC Name: 2-[3-(2,6-dimethyl-4-oxo-1H-pyrimidin-5-yl)propanoylamino]benzoate Traditional Name: 2-[3-(4-keto-2,6-dimethyl-1H-pyrimidin-5-yl)propanoylamino]benzoate Formula: C16H16N3O4- MolecularWeight: 314.31594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C)CCC(=O)NC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C)CCC(=O)NC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C16H17N3O4/c1-9-11(15(21)18-10(2)17-9)7-8-14(20)19-13-6-4-3-5-12(13)16(22)23/h3-6H,7-8H2,1-2H3,(H,19,20)(H,22,23)(H,17,18,21)/p-1