N4-cyclopropyl-N1-[3-(4-ethylpiperazin-4-ium-1-yl)propyl]benzene-1,4-disulfonamide

Systemtic Name: N4-cyclopropyl-N1-[3-(4-ethylpiperazin-4-ium-1-yl)propyl]benzene-1,4-disulfonamide Openeye Name: N4-cyclopropyl-N1-[3-(4-ethylpiperazin-4-ium-1-yl)propyl]benzene-1,4-disulfonamide CAS Name: N4-cyclopropyl-N1-[3-(4-ethyl-1-piperazin-4-iumyl)propyl]benzene-1,4-disulfonamide IUPAC Name: 4-N-cyclopropyl-1-N-[3-(4-ethylpiperazin-4-ium-1-yl)propyl]benzene-1,4-disulfonamide Traditional Name: N'-cyclopropyl-N-[3-(4-ethylpiperazin-4-ium-1-yl)propyl]benzene-1,4-disulfonamide Formula: C18H31N4O4S2+ MolecularWeight: 431.59314

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CCCNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3CC3

Isomeric SMILES

CC[NH+]1CCN(CC1)CCCNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3CC3

InChI

InChI=1S/C18H30N4O4S2/c1-2-21-12-14-22(15-13-21)11-3-10-19-27(23,24)17-6-8-18(9-7-17)28(25,26)20-16-4-5-16/h6-9,16,19-20H,2-5,10-15H2,1H3/p+1