1-(3-phenylpropyl)-4-(phenylsulfonyl)piperazin-1-ium

Systemtic Name: 1-(3-phenylpropyl)-4-(phenylsulfonyl)piperazin-1-ium Openeye Name: 1-(benzenesulfonyl)-4-(3-phenylpropyl)piperazin-4-ium CAS Name: 1-(benzenesulfonyl)-4-(3-phenylpropyl)piperazin-4-ium IUPAC Name: 1-(benzenesulfonyl)-4-(3-phenylpropyl)piperazin-4-ium Traditional Name: 1-besyl-4-(3-phenylpropyl)piperazin-4-ium Formula: C19H25N2O2S+ MolecularWeight: 345.479

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H24N2O2S/c22-24(23,19-11-5-2-6-12-19)21-16-14-20(15-17-21)13-7-10-18-8-3-1-4-9-18/h1-6,8-9,11-12H,7,10,13-17H2/p+1