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

Systemtic Name: 3,4-dimethyl-5-[(5-methyl-1,2-oxazol-3-yl)azanidylsulfonyl]benzoate Openeye Name: 3,4-dimethyl-5-(5-methylisoxazol-3-yl)azanidylsulfonyl-benzoate CAS Name: 3,4-dimethyl-5-[(5-methyl-3-isoxazolyl)azanidylsulfonyl]benzoate IUPAC Name: 3,4-dimethyl-5-[(5-methyl-1,2-oxazol-3-yl)azanidylsulfonyl]benzoate Traditional Name: 3,4-dimethyl-5-(5-methylisoxazol-3-yl)azanidylsulfonyl-benzoate Formula: C13H12N2O5S-2 MolecularWeight: 308.30978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)[N-]S(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)[N-]S(=O)(=O)C2=CC(=CC(=C2C)C)C(=O)[O-]

InChI

InChI=1S/C13H14N2O5S/c1-7-4-10(13(16)17)6-11(9(7)3)21(18,19)15-12-5-8(2)20-14-12/h4-6H,1-3H3,(H2,14,15,16,17)/p-2