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

Systemtic Name: 4-methyl-3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]benzoate Openeye Name: 4-methyl-3-[(5-methylisoxazol-3-yl)methylsulfonylamino]benzoate CAS Name: 4-methyl-3-[(5-methyl-3-isoxazolyl)methylsulfonylamino]benzoate IUPAC Name: 4-methyl-3-[(5-methyl-1,2-oxazol-3-yl)methylsulfonylamino]benzoate Traditional Name: 4-methyl-3-[(5-methylisoxazol-3-yl)methylsulfonylamino]benzoate Formula: C13H13N2O5S- MolecularWeight: 309.31772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NS(=O)(=O)CC2=NOC(=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NS(=O)(=O)CC2=NOC(=C2)C

InChI

InChI=1S/C13H14N2O5S/c1-8-3-4-10(13(16)17)6-12(8)15-21(18,19)7-11-5-9(2)20-14-11/h3-6,15H,7H2,1-2H3,(H,16,17)/p-1