2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octylsulfonyl-[(2-nitrophenyl)methyl]amino]-N-oxidanyl-propanamide

Systemtic Name: 2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octylsulfonyl-[(2-nitrophenyl)methyl]amino]-N-oxidanyl-propanamide Openeye Name: 2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl-[(2-nitrophenyl)methyl]amino]propanehydroxamic acid CAS Name: 2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl-[(2-nitrophenyl)methyl]amino]-N-hydroxypropanamide IUPAC Name: 2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl-[(2-nitrophenyl)methyl]amino]-N-hydroxypropanamide Traditional Name: 2-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl-(2-nitrobenzyl)amino]propanehydroxamic acid Formula: C18H12F17N3O6S MolecularWeight: 721.342234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NO)N(CC1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

CC(C(=O)NO)N(CC1=CC=CC=C1[N+](=O)[O-])S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C18H12F17N3O6S/c1-7(10(39)36-40)37(6-8-4-2-3-5-9(8)38(41)42)45(43,44)18(34,35)16(29,30)14(25,26)12(21,22)11(19,20)13(23,24)15(27,28)17(31,32)33/h2-5,7,40H,6H2,1H3,(H,36,39)