3-azanyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide

Systemtic Name: 3-azanyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide Openeye Name: 3-amino-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide CAS Name: 3-amino-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]benzenesulfonamide IUPAC Name: 3-amino-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide Traditional Name: 3-amino-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]benzenesulfonamide Formula: C15H26N3O2S+ MolecularWeight: 312.45084

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNS(=O)(=O)C2=CC=CC(=C2)N

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNS(=O)(=O)C2=CC=CC(=C2)N

InChI

InChI=1S/C15H25N3O2S/c1-13-6-2-3-10-18(13)11-5-9-17-21(19,20)15-8-4-7-14(16)12-15/h4,7-8,12-13,17H,2-3,5-6,9-11,16H2,1H3/p+1/t13-/m0/s1