(3R)-3-methyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-oxidanylidene-1,3-dihydroindole-5-sulfonamide

Systemtic Name: (3R)-3-methyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-oxidanylidene-1,3-dihydroindole-5-sulfonamide Openeye Name: (3R)-3-methyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-oxo-indoline-5-sulfonamide CAS Name: (3R)-3-methyl-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-2-oxo-1,3-dihydroindole-5-sulfonamide IUPAC Name: (3R)-3-methyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-oxo-1,3-dihydroindole-5-sulfonamide Traditional Name: (3R)-2-keto-3-methyl-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]indoline-5-sulfonamide Formula: C21H26N3O4S+ MolecularWeight: 416.51384

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=CC(=C2)S(=O)(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4)NC1=O

Isomeric SMILES

C[C@@H]1C2=C(C=CC(=C2)S(=O)(=O)NCC3=CC=CC=C3C[NH+]4CCOCC4)NC1=O

InChI

InChI=1S/C21H25N3O4S/c1-15-19-12-18(6-7-20(19)23-21(15)25)29(26,27)22-13-16-4-2-3-5-17(16)14-24-8-10-28-11-9-24/h2-7,12,15,22H,8-11,13-14H2,1H3,(H,23,25)/p+1/t15-/m1/s1