methyl 3-[(5-nitrothiophen-3-yl)carbonylcarbamoylamino]benzoate

Systemtic Name: methyl 3-[(5-nitrothiophen-3-yl)carbonylcarbamoylamino]benzoate Openeye Name: methyl 3-[(5-nitrothiophene-3-carbonyl)carbamoylamino]benzoate CAS Name: 3-[[[[(5-nitro-3-thiophenyl)-oxomethyl]amino]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(5-nitrothiophene-3-carbonyl)carbamoylamino]benzoate Traditional Name: 3-[(5-nitrothiophene-3-carbonyl)carbamoylamino]benzoic acid methyl ester Formula: C14H11N3O6S MolecularWeight: 349.31864

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)NC(=O)C2=CSC(=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)NC(=O)C2=CSC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O6S/c1-23-13(19)8-3-2-4-10(5-8)15-14(20)16-12(18)9-6-11(17(21)22)24-7-9/h2-7H,1H3,(H2,15,16,18,20)