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

Systemtic Name: methyl 1-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[(4,5-dibromothiophene-2-carbonyl)amino]cyclohexanecarboxylate CAS Name: 1-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4,5-dibromothiophene-2-carbonyl)amino]cyclohexane-1-carboxylate Traditional Name: 1-[(4,5-dibromothiophene-2-carbonyl)amino]cyclohexanecarboxylic acid methyl ester Formula: C13H15Br2NO3S MolecularWeight: 425.1361

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=CC(=C(S2)Br)Br

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C13H15Br2NO3S/c1-19-12(18)13(5-3-2-4-6-13)16-11(17)9-7-8(14)10(15)20-9/h7H,2-6H2,1H3,(H,16,17)