(2-nitrophenyl)methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: (2-nitrophenyl)methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: (2-nitrophenyl)methyl 2-acetamido-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-acetamido-4,5-dimethyl-3-thiophenecarboxylic acid (2-nitrophenyl)methyl ester IUPAC Name: (2-nitrophenyl)methyl 2-acetamido-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-acetamido-4,5-dimethyl-thiophene-3-carboxylic acid (2-nitrobenzyl) ester Formula: C16H16N2O5S MolecularWeight: 348.37364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OCC2=CC=CC=C2[N+](=O)[O-])NC(=O)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OCC2=CC=CC=C2[N+](=O)[O-])NC(=O)C)C

InChI

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