4-chloranyl-3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylazanidyl]benzoate

Systemtic Name: 4-chloranyl-3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylazanidyl]benzoate Openeye Name: 4-chloro-3-[(5-methylisoxazol-3-yl)methylsulfonylazanidyl]benzoate CAS Name: 4-chloro-3-[(5-methyl-3-isoxazolyl)methylsulfonylazanidyl]benzoate IUPAC Name: 4-chloro-3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylazanidyl]benzoate Traditional Name: 4-chloro-3-[(5-methylisoxazol-3-yl)methylsulfonylazanidyl]benzoate Formula: C12H9ClN2O5S-2 MolecularWeight: 328.72826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CS(=O)(=O)[N-]C2=C(C=CC(=C2)C(=O)[O-])Cl

Isomeric SMILES

CC1=CC(=NO1)CS(=O)(=O)[N-]C2=C(C=CC(=C2)C(=O)[O-])Cl

InChI

InChI=1S/C12H10ClN2O5S/c1-7-4-9(14-20-7)6-21(18,19)15-11-5-8(12(16)17)2-3-10(11)13/h2-5H,6H2,1H3,(H,16,17)/q-1/p-1