1-(1-methylpyrrol-2-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanone

Systemtic Name: 1-(1-methylpyrrol-2-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanone Openeye Name: 1-(1-methylpyrrol-2-yl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)ethanone CAS Name: 1-(1-methyl-2-pyrrolyl)-2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]ethanone IUPAC Name: 1-(1-methylpyrrol-2-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)ethanone Traditional Name: 1-(1-methylpyrrol-2-yl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)ethanone Formula: C17H19N3O7S MolecularWeight: 409.41366

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1C(=O)COC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N3O7S/c1-18-6-2-3-14(18)16(21)12-27-17-5-4-13(11-15(17)20(22)23)28(24,25)19-7-9-26-10-8-19/h2-6,11H,7-10,12H2,1H3