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

Systemtic Name: [4-(4-butylsulfonylpiperazin-1-yl)phenyl]methylazanium Openeye Name: [4-(4-butylsulfonylpiperazin-1-yl)phenyl]methylammonium CAS Name: [4-(4-butylsulfonyl-1-piperazinyl)phenyl]methylammonium IUPAC Name: [4-(4-butylsulfonylpiperazin-1-yl)phenyl]methylazanium Traditional Name: [4-(4-butylsulfonylpiperazino)benzyl]ammonium Formula: C15H26N3O2S+ MolecularWeight: 312.45084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N3O2S/c1-2-3-12-21(19,20)18-10-8-17(9-11-18)15-6-4-14(13-16)5-7-15/h4-7H,2-3,8-13,16H2,1H3/p+1