(2S)-2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide

Systemtic Name: (2S)-2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Openeye Name: (2S)-2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1-methylsulfonyl-indoline-5-carboxamide CAS Name: (2S)-2-methyl-N-[3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide IUPAC Name: (2S)-2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Traditional Name: (2S)-1-mesyl-2-methyl-N-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]indoline-5-carboxamide Formula: C20H32N3O3S+ MolecularWeight: 394.55138

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)N(C(C3)C)S(=O)(=O)C

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCCNC(=O)C2=CC3=C(C=C2)N([C@H](C3)C)S(=O)(=O)C

InChI

InChI=1S/C20H31N3O3S/c1-15-7-4-5-11-22(15)12-6-10-21-20(24)17-8-9-19-18(14-17)13-16(2)23(19)27(3,25)26/h8-9,14-16H,4-7,10-13H2,1-3H3,(H,21,24)/p+1/t15-,16-/m0/s1