2-[2-(4-methoxyphenoxy)ethanoylcarbamothioylamino]-4-nitro-phenolate

Systemtic Name: 2-[2-(4-methoxyphenoxy)ethanoylcarbamothioylamino]-4-nitro-phenolate Openeye Name: 2-[[2-(4-methoxyphenoxy)acetyl]carbamothioylamino]-4-nitro-phenolate CAS Name: 2-[[[[2-(4-methoxyphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-4-nitrophenolate IUPAC Name: 2-[[2-(4-methoxyphenoxy)acetyl]carbamothioylamino]-4-nitrophenolate Traditional Name: 2-[[2-(4-methoxyphenoxy)acetyl]thiocarbamoylamino]-4-nitro-phenolate Formula: C16H14N3O6S- MolecularWeight: 376.36386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

COC1=CC=C(C=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C16H15N3O6S/c1-24-11-3-5-12(6-4-11)25-9-15(21)18-16(26)17-13-8-10(19(22)23)2-7-14(13)20/h2-8,20H,9H2,1H3,(H2,17,18,21,26)/p-1