methyl 2-[2-(3-bromophenyl)carbonyloxyethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(3-bromophenyl)carbonyloxyethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(3-bromobenzoyl)oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(3-bromophenyl)-oxomethoxy]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3-bromobenzoyl)oxyacetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-(3-bromobenzoyl)oxyacetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C17H16BrNO5S MolecularWeight: 426.28164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC(=CC=C2)Br)C

InChI

InChI=1S/C17H16BrNO5S/c1-9-10(2)25-15(14(9)17(22)23-3)19-13(20)8-24-16(21)11-5-4-6-12(18)7-11/h4-7H,8H2,1-3H3,(H,19,20)