2-(5-methyl-2-nitro-phenoxy)-1-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)ethanone

Systemtic Name: 2-(5-methyl-2-nitro-phenoxy)-1-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)ethanone Openeye Name: 2-(5-methyl-2-nitro-phenoxy)-1-[5-(1-piperidylsulfonyl)indolin-1-yl]ethanone CAS Name: 2-(5-methyl-2-nitrophenoxy)-1-[5-(1-piperidinylsulfonyl)-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 2-(5-methyl-2-nitrophenoxy)-1-(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-(5-methyl-2-nitro-phenoxy)-1-(5-piperidinosulfonylindolin-1-yl)ethanone Formula: C22H25N3O6S MolecularWeight: 459.5154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])OCC(=O)N2CCC3=C2C=CC(=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H25N3O6S/c1-16-5-7-20(25(27)28)21(13-16)31-15-22(26)24-12-9-17-14-18(6-8-19(17)24)32(29,30)23-10-3-2-4-11-23/h5-8,13-14H,2-4,9-12,15H2,1H3