dimethyl 5-azanyl-3-[(5-bromanylpyridin-3-yl)carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[(5-bromanylpyridin-3-yl)carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(5-bromopyridine-3-carbonyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[(5-bromo-3-pyridinyl)-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(5-bromopyridine-3-carbonyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(5-bromonicotinoyl)oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C15H13BrN2O6S MolecularWeight: 429.24252

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)C2=CC(=CN=C2)Br)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)C2=CC(=CN=C2)Br)C(=O)OC)N

InChI

InChI=1S/C15H13BrN2O6S/c1-22-14(20)10-9(11(15(21)23-2)25-12(10)17)6-24-13(19)7-3-8(16)5-18-4-7/h3-5H,6,17H2,1-2H3