dimethyl (2S,4R)-1-(5-bromanylthiophen-2-yl)carbonylazetidine-2,4-dicarboxylate

Systemtic Name: dimethyl (2S,4R)-1-(5-bromanylthiophen-2-yl)carbonylazetidine-2,4-dicarboxylate Openeye Name: dimethyl (2S,4R)-1-(5-bromothiophene-2-carbonyl)azetidine-2,4-dicarboxylate CAS Name: (2S,4R)-1-[(5-bromo-2-thiophenyl)-oxomethyl]azetidine-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,4R)-1-(5-bromothiophene-2-carbonyl)azetidine-2,4-dicarboxylate Traditional Name: (2S,4R)-1-(5-bromothiophene-2-carbonyl)azetidine-2,4-dicarboxylic acid dimethyl ester Formula: C12H12BrNO5S MolecularWeight: 362.19638

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(N1C(=O)C2=CC=C(S2)Br)C(=O)OC

Isomeric SMILES

COC(=O)[C@H]1C[C@H](N1C(=O)C2=CC=C(S2)Br)C(=O)OC

InChI

InChI=1S/C12H12BrNO5S/c1-18-11(16)6-5-7(12(17)19-2)14(6)10(15)8-3-4-9(13)20-8/h3-4,6-7H,5H2,1-2H3/t6-,7+