ethyl 3-nitro-5-(1-thiophen-2-ylethylcarbamoyl)benzoate

Systemtic Name: ethyl 3-nitro-5-(1-thiophen-2-ylethylcarbamoyl)benzoate Openeye Name: ethyl 3-nitro-5-[1-(2-thienyl)ethylcarbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-(1-thiophen-2-ylethylamino)methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-(1-thiophen-2-ylethylcarbamoyl)benzoate Traditional Name: 3-nitro-5-[1-(2-thienyl)ethylcarbamoyl]benzoic acid ethyl ester Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC(C)C2=CC=CS2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC(C)C2=CC=CS2)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O5S/c1-3-23-16(20)12-7-11(8-13(9-12)18(21)22)15(19)17-10(2)14-5-4-6-24-14/h4-10H,3H2,1-2H3,(H,17,19)