5-[2,4-bis(oxidanylidene)-1,3-diazinan-1-yl]-2-oxidanyl-3-propan-2-yl-benzoate

Systemtic Name: 5-[2,4-bis(oxidanylidene)-1,3-diazinan-1-yl]-2-oxidanyl-3-propan-2-yl-benzoate Openeye Name: 5-(2,4-dioxohexahydropyrimidin-1-yl)-2-hydroxy-3-isopropyl-benzoate CAS Name: 5-(2,4-dioxo-1,3-diazinan-1-yl)-2-hydroxy-3-propan-2-ylbenzoate IUPAC Name: 5-(2,4-dioxo-1,3-diazinan-1-yl)-2-hydroxy-3-propan-2-ylbenzoate Traditional Name: 5-(2,4-diketohexahydropyrimidin-1-yl)-2-hydroxy-3-isopropyl-benzoate Formula: C14H15N2O5- MolecularWeight: 291.2793

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC(=C1)N2CCC(=O)NC2=O)C(=O)[O-])O

Isomeric SMILES

CC(C)C1=C(C(=CC(=C1)N2CCC(=O)NC2=O)C(=O)[O-])O

InChI

InChI=1S/C14H16N2O5/c1-7(2)9-5-8(6-10(12(9)18)13(19)20)16-4-3-11(17)15-14(16)21/h5-7,18H,3-4H2,1-2H3,(H,19,20)(H,15,17,21)/p-1