3-pyrimidin-2-ylazanidylsulfonylbenzoate

Systemtic Name: 3-pyrimidin-2-ylazanidylsulfonylbenzoate Openeye Name: 3-pyrimidin-2-ylazanidylsulfonylbenzoate CAS Name: 3-(2-pyrimidinylazanidylsulfonyl)benzoate IUPAC Name: 3-pyrimidin-2-ylazanidylsulfonylbenzoate Traditional Name: 3-(2-pyrimidylazanidylsulfonyl)benzoate Formula: C11H7N3O4S-2 MolecularWeight: 277.25598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9N3O4S/c15-10(16)8-3-1-4-9(7-8)19(17,18)14-11-12-5-2-6-13-11/h1-7H,(H2,12,13,14,15,16)/p-2