N-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-3H-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-3H-1,3-benzoxazole-6-sulfonamide Openeye Name: N-(4-methylpiperazin-4-ium-1-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide CAS Name: N-(4-methyl-1-piperazin-4-iumyl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-(4-methylpiperazin-4-ium-1-yl)-2-oxo-3H-1,3-benzoxazole-6-sulfonamide Traditional Name: 2-keto-N-(4-methylpiperazin-4-ium-1-yl)-3H-1,3-benzoxazole-6-sulfonamide Formula: C12H17N4O4S+ MolecularWeight: 313.35278

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

Isomeric SMILES

C[NH+]1CCN(CC1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

InChI

InChI=1S/C12H16N4O4S/c1-15-4-6-16(7-5-15)14-21(18,19)9-2-3-10-11(8-9)20-12(17)13-10/h2-3,8,14H,4-7H2,1H3,(H,13,17)/p+1