methyl 3-nitro-5-(2-thiophen-3-ylethylcarbamoyl)benzoate

Systemtic Name: methyl 3-nitro-5-(2-thiophen-3-ylethylcarbamoyl)benzoate Openeye Name: methyl 3-nitro-5-[2-(3-thienyl)ethylcarbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[2-(3-thiophenyl)ethylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-5-(2-thiophen-3-ylethylcarbamoyl)benzoate Traditional Name: 3-nitro-5-[2-(3-thienyl)ethylcarbamoyl]benzoic acid methyl ester Formula: C15H14N2O5S MolecularWeight: 334.34706

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C(=O)NCCC2=CSC=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C(=O)NCCC2=CSC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O5S/c1-22-15(19)12-6-11(7-13(8-12)17(20)21)14(18)16-4-2-10-3-5-23-9-10/h3,5-9H,2,4H2,1H3,(H,16,18)