1-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanoyl]-2,3-dihydroindole-5-sulfonamide

Systemtic Name: 1-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]ethanoyl]-2,3-dihydroindole-5-sulfonamide Openeye Name: 1-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetyl]indoline-5-sulfonamide CAS Name: 1-[2-[(3S)-3-methyl-1-piperidin-1-iumyl]-1-oxoethyl]-2,3-dihydroindole-5-sulfonamide IUPAC Name: 1-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetyl]-2,3-dihydroindole-5-sulfonamide Traditional Name: 1-[2-[(3S)-3-methylpiperidin-1-ium-1-yl]acetyl]indoline-5-sulfonamide Formula: C16H24N3O3S+ MolecularWeight: 338.44506

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N

InChI

InChI=1S/C16H23N3O3S/c1-12-3-2-7-18(10-12)11-16(20)19-8-6-13-9-14(23(17,21)22)4-5-15(13)19/h4-5,9,12H,2-3,6-8,10-11H2,1H3,(H2,17,21,22)/p+1/t12-/m0/s1