[[4,7-bis(chloranyl)-1-benzothiophen-2-yl]sulfonylamino]methyl-[4-bromanyl-3-[[4-nitro-2-(trifluoromethyl)phenyl]carbamoyl]phenoxy]phosphinic acid

Systemtic Name: [[4,7-bis(chloranyl)-1-benzothiophen-2-yl]sulfonylamino]methyl-[4-bromanyl-3-[[4-nitro-2-(trifluoromethyl)phenyl]carbamoyl]phenoxy]phosphinic acid Openeye Name: [4-bromo-3-[[4-nitro-2-(trifluoromethyl)phenyl]carbamoyl]phenoxy]-[[(4,7-dichlorobenzothiophen-2-yl)sulfonylamino]methyl]phosphinic acid CAS Name: [4-bromo-3-[[4-nitro-2-(trifluoromethyl)anilino]-oxomethyl]phenoxy]-[[(4,7-dichloro-1-benzothiophen-2-yl)sulfonylamino]methyl]phosphinic acid IUPAC Name: [4-bromo-3-[[4-nitro-2-(trifluoromethyl)phenyl]carbamoyl]phenoxy]-[[(4,7-dichloro-1-benzothiophen-2-yl)sulfonylamino]methyl]phosphinic acid Traditional Name: [4-bromo-3-[[4-nitro-2-(trifluoromethyl)phenyl]carbamoyl]phenoxy]-[[(4,7-dichlorobenzothiophen-2-yl)sulfonylamino]methyl]phosphinic acid Formula: C23H14BrCl2F3N3O8PS2 MolecularWeight: 763.281531

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)NC(=O)C2=C(C=CC(=C2)OP(=O)(CNS(=O)(=O)C3=CC4=C(C=CC(=C4S3)Cl)Cl)O)Br

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)NC(=O)C2=C(C=CC(=C2)OP(=O)(CNS(=O)(=O)C3=CC4=C(C=CC(=C4S3)Cl)Cl)O)Br

InChI

InChI=1S/C23H14BrCl2F3N3O8PS2/c24-16-3-2-12(8-13(16)22(33)31-19-6-1-11(32(34)35)7-15(19)23(27,28)29)40-41(36,37)10-30-43(38,39)20-9-14-17(25)4-5-18(26)21(14)42-20/h1-9,30H,10H2,(H,31,33)(H,36,37)