2-[[(5-chloranylthiophen-2-yl)carbonylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[(5-chloranylthiophen-2-yl)carbonylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[(5-chlorothiophene-2-carbonyl)amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[(5-chloro-2-thiophenyl)-oxomethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[(5-chlorothiophene-2-carbonyl)amino]methyl]-4-nitrophenolate Traditional Name: 2-[[(5-chlorothiophene-2-carbonyl)amino]methyl]-4-nitro-phenolate Formula: C12H8ClN2O4S- MolecularWeight: 311.72092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])CNC(=O)C2=CC=C(S2)Cl)[O-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])CNC(=O)C2=CC=C(S2)Cl)[O-]

InChI

InChI=1S/C12H9ClN2O4S/c13-11-4-3-10(20-11)12(17)14-6-7-5-8(15(18)19)1-2-9(7)16/h1-5,16H,6H2,(H,14,17)/p-1