N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-oxidanylidene-3H-1,3-benzoxazole-6-sulfonamide

Systemtic Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-oxidanylidene-3H-1,3-benzoxazole-6-sulfonamide Openeye Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide CAS Name: N-[3-(4-methyl-1-piperazine-1,4-diiumyl)propyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide IUPAC Name: N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-2-oxo-3H-1,3-benzoxazole-6-sulfonamide Traditional Name: 2-keto-N-[3-(4-methylpiperazine-1,4-diium-1-yl)propyl]-3H-1,3-benzoxazole-6-sulfonamide Formula: C15H24N4O4S+2 MolecularWeight: 356.44046

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC3=C(C=C2)NC(=O)O3

InChI

InChI=1S/C15H22N4O4S/c1-18-7-9-19(10-8-18)6-2-5-16-24(21,22)12-3-4-13-14(11-12)23-15(20)17-13/h3-4,11,16H,2,5-10H2,1H3,(H,17,20)/p+2