methyl 1-[4,5-bis(bromanyl)thiophen-2-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[4,5-bis(bromanyl)thiophen-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-(4,5-dibromothiophene-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(4,5-dibromo-2-thiophenyl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4,5-dibromothiophene-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(4,5-dibromothiophene-2-carbonyl)isonipecotic acid methyl ester Formula: C12H13Br2NO3S MolecularWeight: 411.10952

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)C2=CC(=C(S2)Br)Br

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C12H13Br2NO3S/c1-18-12(17)7-2-4-15(5-3-7)11(16)9-6-8(13)10(14)19-9/h6-7H,2-5H2,1H3