2,6-bis(bromanyl)-4-[2-(4-nitrophenoxy)ethanoylcarbamothioylamino]phenolate

Systemtic Name: 2,6-bis(bromanyl)-4-[2-(4-nitrophenoxy)ethanoylcarbamothioylamino]phenolate Openeye Name: 2,6-dibromo-4-[[2-(4-nitrophenoxy)acetyl]carbamothioylamino]phenolate CAS Name: 2,6-dibromo-4-[[[[2-(4-nitrophenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenolate IUPAC Name: 2,6-dibromo-4-[[2-(4-nitrophenoxy)acetyl]carbamothioylamino]phenolate Traditional Name: 2,6-dibromo-4-[[2-(4-nitrophenoxy)acetyl]thiocarbamoylamino]phenolate Formula: C15H10Br2N3O5S- MolecularWeight: 504.13

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NC(=S)NC2=CC(=C(C(=C2)Br)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OCC(=O)NC(=S)NC2=CC(=C(C(=C2)Br)[O-])Br

InChI

InChI=1S/C15H11Br2N3O5S/c16-11-5-8(6-12(17)14(11)22)18-15(26)19-13(21)7-25-10-3-1-9(2-4-10)20(23)24/h1-6,22H,7H2,(H2,18,19,21,26)/p-1