N-[(1S,2S)-1-(3-oxidanylidenepiperazin-1-ium-1-yl)-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide

Systemtic Name: N-[(1S,2S)-1-(3-oxidanylidenepiperazin-1-ium-1-yl)-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide Openeye Name: N-[(1S,2S)-1-(3-oxopiperazin-1-ium-1-yl)indan-2-yl]benzenesulfonamide CAS Name: N-[(1S,2S)-1-(3-oxo-1-piperazin-1-iumyl)-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide IUPAC Name: N-[(1S,2S)-1-(3-oxopiperazin-1-ium-1-yl)-2,3-dihydro-1H-inden-2-yl]benzenesulfonamide Traditional Name: N-[(1S,2S)-1-(3-ketopiperazin-1-ium-1-yl)indan-2-yl]benzenesulfonamide Formula: C19H22N3O3S+ MolecularWeight: 372.46128

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)C2C(CC3=CC=CC=C23)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CC(=O)N1)[C@@H]2[C@H](CC3=CC=CC=C23)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C19H21N3O3S/c23-18-13-22(11-10-20-18)19-16-9-5-4-6-14(16)12-17(19)21-26(24,25)15-7-2-1-3-8-15/h1-9,17,19,21H,10-13H2,(H,20,23)/p+1/t17-,19-/m0/s1