(4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-yl)methyl 2-azanyl-4-chloranyl-5-sulfamoyl-benzoate

Systemtic Name: (4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-yl)methyl 2-azanyl-4-chloranyl-5-sulfamoyl-benzoate Openeye Name: (4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)methyl 2-amino-4-chloro-5-sulfamoyl-benzoate CAS Name: 2-amino-4-chloro-5-sulfamoylbenzoic acid (4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)methyl ester IUPAC Name: (4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-yl)methyl 2-amino-4-chloro-5-sulfamoylbenzoate Traditional Name: 2-amino-4-chloro-5-sulfamoyl-benzoic acid (4-methyl-5-oxido-furazan-5-ium-3-yl)methyl ester Formula: C11H11ClN4O6S MolecularWeight: 362.74624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](ON=C1COC(=O)C2=CC(=C(C=C2N)Cl)S(=O)(=O)N)[O-]

Isomeric SMILES

CC1=[N+](ON=C1COC(=O)C2=CC(=C(C=C2N)Cl)S(=O)(=O)N)[O-]

InChI

InChI=1S/C11H11ClN4O6S/c1-5-9(15-22-16(5)18)4-21-11(17)6-2-10(23(14,19)20)7(12)3-8(6)13/h2-3H,4,13H2,1H3,(H2,14,19,20)