[3-oxidanylidene-3-[4-(phenylsulfonyl)piperazin-1-yl]propyl]azanium

Systemtic Name: [3-oxidanylidene-3-[4-(phenylsulfonyl)piperazin-1-yl]propyl]azanium Openeye Name: [3-[4-(benzenesulfonyl)piperazin-1-yl]-3-oxo-propyl]ammonium CAS Name: [3-[4-(benzenesulfonyl)-1-piperazinyl]-3-oxopropyl]ammonium IUPAC Name: [3-[4-(benzenesulfonyl)piperazin-1-yl]-3-oxopropyl]azanium Traditional Name: [3-(4-besylpiperazino)-3-keto-propyl]ammonium Formula: C13H20N3O3S+ MolecularWeight: 298.3812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CC[NH3+])S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1C(=O)CC[NH3+])S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H19N3O3S/c14-7-6-13(17)15-8-10-16(11-9-15)20(18,19)12-4-2-1-3-5-12/h1-5H,6-11,14H2/p+1