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

Systemtic Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxidanylidene-3H-1,3-benzoxazole-6-sulfonamide Openeye Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide CAS Name: N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide Traditional Name: 2-keto-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-3H-1,3-benzoxazole-6-sulfonamide Formula: C18H21N4O4S+ MolecularWeight: 389.44874

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC4=C(C=C3)NC(=O)O4

InChI

InChI=1S/C18H20N4O4S/c1-21-8-10-22(11-9-21)16-5-3-2-4-14(16)20-27(24,25)13-6-7-15-17(12-13)26-18(23)19-15/h2-7,12,20H,8-11H2,1H3,(H,19,23)/p+1