[3-(4-propylpiperazin-4-ium-1-yl)sulfonylphenyl]methylazanium

Systemtic Name: [3-(4-propylpiperazin-4-ium-1-yl)sulfonylphenyl]methylazanium Openeye Name: [3-(4-propylpiperazin-4-ium-1-yl)sulfonylphenyl]methylammonium CAS Name: [3-[(4-propyl-1-piperazin-4-iumyl)sulfonyl]phenyl]methylammonium IUPAC Name: [3-(4-propylpiperazin-4-ium-1-yl)sulfonylphenyl]methylazanium Traditional Name: [3-(4-propylpiperazin-4-ium-1-yl)sulfonylbenzyl]ammonium Formula: C14H25N3O2S+2 MolecularWeight: 299.4322

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C14H23N3O2S/c1-2-6-16-7-9-17(10-8-16)20(18,19)14-5-3-4-13(11-14)12-15/h3-5,11H,2,6-10,12,15H2,1H3/p+2