1-[5-bromanyl-7-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 1-[5-bromanyl-7-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 1-[5-bromo-7-[4-(4-chloro-2-nitro-phenyl)piperazin-1-yl]sulfonyl-indolin-1-yl]ethanone CAS Name: 1-[5-bromo-7-[[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]sulfonyl]-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 1-[5-bromo-7-[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone Traditional Name: 1-[5-bromo-7-[4-(4-chloro-2-nitro-phenyl)piperazino]sulfonyl-indolin-1-yl]ethanone Formula: C20H20BrClN4O5S MolecularWeight: 543.8186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-])Br

Isomeric SMILES

CC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)N3CCN(CC3)C4=C(C=C(C=C4)Cl)[N+](=O)[O-])Br

InChI

InChI=1S/C20H20BrClN4O5S/c1-13(27)25-5-4-14-10-15(21)11-19(20(14)25)32(30,31)24-8-6-23(7-9-24)17-3-2-16(22)12-18(17)26(28)29/h2-3,10-12H,4-9H2,1H3