N,N-diethyl-3-(2-methylphenyl)-5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-4-sulfonamide

Systemtic Name: N,N-diethyl-3-(2-methylphenyl)-5-oxidanylidene-2H-1,2,3-oxadiazol-3-ium-4-sulfonamide Openeye Name: N,N-diethyl-3-(o-tolyl)-5-oxo-2H-oxadiazol-3-ium-4-sulfonamide CAS Name: N,N-diethyl-3-(2-methylphenyl)-5-oxo-2H-oxadiazol-3-ium-4-sulfonamide IUPAC Name: N,N-diethyl-3-(2-methylphenyl)-5-oxo-2H-oxadiazol-3-ium-4-sulfonamide Traditional Name: N,N-diethyl-5-keto-3-(o-tolyl)-2H-oxadiazol-3-ium-4-sulfonamide Formula: C13H18N3O4S+ MolecularWeight: 312.36472

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=[N+](NOC1=O)C2=CC=CC=C2C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=[N+](NOC1=O)C2=CC=CC=C2C

InChI

InChI=1S/C13H17N3O4S/c1-4-15(5-2)21(18,19)12-13(17)20-14-16(12)11-9-7-6-8-10(11)3/h6-9H,4-5H2,1-3H3/p+1