1-(5-bromanylthiophen-2-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanone

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitro-phenoxy)ethanone Openeye Name: 1-(5-bromo-2-thienyl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)ethanone CAS Name: 1-(5-bromo-2-thiophenyl)-2-[4-(4-morpholinylsulfonyl)-2-nitrophenoxy]ethanone IUPAC Name: 1-(5-bromothiophen-2-yl)-2-(4-morpholin-4-ylsulfonyl-2-nitrophenoxy)ethanone Traditional Name: 1-(5-bromo-2-thienyl)-2-(4-morpholinosulfonyl-2-nitro-phenoxy)ethanone Formula: C16H15BrN2O7S2 MolecularWeight: 491.3335

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)C3=CC=C(S3)Br)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)OCC(=O)C3=CC=C(S3)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H15BrN2O7S2/c17-16-4-3-15(27-16)13(20)10-26-14-2-1-11(9-12(14)19(21)22)28(23,24)18-5-7-25-8-6-18/h1-4,9H,5-8,10H2