5-bromanyl-1-ethanoyl-N-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-2,3-dihydroindole-7-sulfonamide

Systemtic Name: 5-bromanyl-1-ethanoyl-N-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-2,3-dihydroindole-7-sulfonamide Openeye Name: 1-acetyl-5-bromo-N-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]indoline-7-sulfonamide CAS Name: 1-acetyl-5-bromo-N-[2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]ethyl]-2,3-dihydroindole-7-sulfonamide IUPAC Name: 1-acetyl-5-bromo-N-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]-2,3-dihydroindole-7-sulfonamide Traditional Name: 1-acetyl-5-bromo-N-[2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]ethyl]indoline-7-sulfonamide Formula: C23H30BrN4O4S+ MolecularWeight: 538.4777

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)NCC[NH+]3CCN(CC3)C4=CC=C(C=C4)OC)Br

Isomeric SMILES

CC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)NCC[NH+]3CCN(CC3)C4=CC=C(C=C4)OC)Br

InChI

InChI=1S/C23H29BrN4O4S/c1-17(29)28-9-7-18-15-19(24)16-22(23(18)28)33(30,31)25-8-10-26-11-13-27(14-12-26)20-3-5-21(32-2)6-4-20/h3-6,15-16,25H,7-14H2,1-2H3/p+1