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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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