1-[(5-bromanylthiophen-3-yl)carbonylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[(5-bromanylthiophen-3-yl)carbonylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[(5-bromothiophene-3-carbonyl)amino]cycloheptanecarboxylic acid CAS Name: 1-[[(5-bromo-3-thiophenyl)-oxomethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[(5-bromothiophene-3-carbonyl)amino]cycloheptane-1-carboxylic acid Traditional Name: 1-[(5-bromothiophene-3-carbonyl)amino]cycloheptanecarboxylic acid Formula: C13H16BrNO3S MolecularWeight: 346.24004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CSC(=C2)Br

Isomeric SMILES

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CSC(=C2)Br

InChI

InChI=1S/C13H16BrNO3S/c14-10-7-9(8-19-10)11(16)15-13(12(17)18)5-3-1-2-4-6-13/h7-8H,1-6H2,(H,15,16)(H,17,18)