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

Systemtic Name: 4-methyl-3-[(5-methyl-1,2-oxazol-3-yl)azanidylsulfonyl]benzoate Openeye Name: 4-methyl-3-(5-methylisoxazol-3-yl)azanidylsulfonyl-benzoate CAS Name: 4-methyl-3-[(5-methyl-3-isoxazolyl)azanidylsulfonyl]benzoate IUPAC Name: 4-methyl-3-[(5-methyl-1,2-oxazol-3-yl)azanidylsulfonyl]benzoate Traditional Name: 4-methyl-3-(5-methylisoxazol-3-yl)azanidylsulfonyl-benzoate Formula: C12H10N2O5S-2 MolecularWeight: 294.2832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)[N-]C2=NOC(=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])S(=O)(=O)[N-]C2=NOC(=C2)C

InChI

InChI=1S/C12H12N2O5S/c1-7-3-4-9(12(15)16)6-10(7)20(17,18)14-11-5-8(2)19-13-11/h3-6H,1-2H3,(H2,13,14,15,16)/p-2