1-ethanoyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2,3-dihydroindole-5-sulfonamide

Systemtic Name: 1-ethanoyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2,3-dihydroindole-5-sulfonamide Openeye Name: 1-acetyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]indoline-5-sulfonamide CAS Name: 1-acetyl-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2,3-dihydroindole-5-sulfonamide IUPAC Name: 1-acetyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2,3-dihydroindole-5-sulfonamide Traditional Name: 1-acetyl-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]indoline-5-sulfonamide Formula: C21H27N4O3S+ MolecularWeight: 415.52908

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3N4CC[NH+](CC4)C

Isomeric SMILES

CC(=O)N1CCC2=C1C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3N4CC[NH+](CC4)C

InChI

InChI=1S/C21H26N4O3S/c1-16(26)25-10-9-17-15-18(7-8-20(17)25)29(27,28)22-19-5-3-4-6-21(19)24-13-11-23(2)12-14-24/h3-8,15,22H,9-14H2,1-2H3/p+1