N-(1-ethanoyl-2,3-dihydroindol-5-yl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(1-ethanoyl-2,3-dihydroindol-5-yl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(1-acetylindolin-5-yl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetamide CAS Name: N-(1-acetyl-2,3-dihydroindol-5-yl)-2-(4-methylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(1-acetyl-2,3-dihydroindol-5-yl)-2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(1-acetylindolin-5-yl)-2-(4-mesylpiperazin-1-ium-1-yl)acetamide Formula: C17H25N4O4S+ MolecularWeight: 381.4698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)NC(=O)C[NH+]3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C17H24N4O4S/c1-13(22)21-6-5-14-11-15(3-4-16(14)21)18-17(23)12-19-7-9-20(10-8-19)26(2,24)25/h3-4,11H,5-10,12H2,1-2H3,(H,18,23)/p+1