2-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]-4-nitro-phenolate

Systemtic Name: 2-[(2,6-dimethoxyphenyl)carbonylcarbamothioylamino]-4-nitro-phenolate Openeye Name: 2-[(2,6-dimethoxybenzoyl)carbamothioylamino]-4-nitro-phenolate CAS Name: 2-[[[[(2,6-dimethoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-4-nitrophenolate IUPAC Name: 2-[(2,6-dimethoxybenzoyl)carbamothioylamino]-4-nitrophenolate Traditional Name: 2-[(2,6-dimethoxybenzoyl)thiocarbamoylamino]-4-nitro-phenolate Formula: C16H14N3O6S- MolecularWeight: 376.36386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O6S/c1-24-12-4-3-5-13(25-2)14(12)15(21)18-16(26)17-10-8-9(19(22)23)6-7-11(10)20/h3-8,20H,1-2H3,(H2,17,18,21,26)/p-1