[4-(4-ethylsulfonylpiperazin-1-yl)phenyl]methylazanium

Systemtic Name: [4-(4-ethylsulfonylpiperazin-1-yl)phenyl]methylazanium Openeye Name: [4-(4-ethylsulfonylpiperazin-1-yl)phenyl]methylammonium CAS Name: [4-(4-ethylsulfonyl-1-piperazinyl)phenyl]methylammonium IUPAC Name: [4-(4-ethylsulfonylpiperazin-1-yl)phenyl]methylazanium Traditional Name: [4-(4-esylpiperazino)benzyl]ammonium Formula: C13H22N3O2S+ MolecularWeight: 284.39768

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)C[NH3+]

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)C2=CC=C(C=C2)C[NH3+]

InChI

InChI=1S/C13H21N3O2S/c1-2-19(17,18)16-9-7-15(8-10-16)13-5-3-12(11-14)4-6-13/h3-6H,2,7-11,14H2,1H3/p+1