(2S)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide

Systemtic Name: (2S)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Openeye Name: (2S)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]-2-methyl-1-methylsulfonyl-indoline-5-carboxamide CAS Name: (2S)-N-[(2R)-3-ethyl-2-(4-morpholin-4-iumyl)pentyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide IUPAC Name: (2S)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-ylpentyl]-2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide Traditional Name: (2S)-N-[(2R)-3-ethyl-2-morpholin-4-ium-4-yl-pentyl]-1-mesyl-2-methyl-indoline-5-carboxamide Formula: C22H36N3O4S+ MolecularWeight: 438.60394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)C1=CC2=C(C=C1)N(C(C2)C)S(=O)(=O)C)[NH+]3CCOCC3

Isomeric SMILES

CCC(CC)[C@H](CNC(=O)C1=CC2=C(C=C1)N([C@H](C2)C)S(=O)(=O)C)[NH+]3CCOCC3

InChI

InChI=1S/C22H35N3O4S/c1-5-17(6-2)21(24-9-11-29-12-10-24)15-23-22(26)18-7-8-20-19(14-18)13-16(3)25(20)30(4,27)28/h7-8,14,16-17,21H,5-6,9-13,15H2,1-4H3,(H,23,26)/p+1/t16-,21-/m0/s1