1-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]cycloheptane-1-carboxylic acid

Systemtic Name: 1-[[4,5-bis(bromanyl)thiophen-2-yl]carbonylamino]cycloheptane-1-carboxylic acid Openeye Name: 1-[(4,5-dibromothiophene-2-carbonyl)amino]cycloheptanecarboxylic acid CAS Name: 1-[[(4,5-dibromo-2-thiophenyl)-oxomethyl]amino]-1-cycloheptanecarboxylic acid IUPAC Name: 1-[(4,5-dibromothiophene-2-carbonyl)amino]cycloheptane-1-carboxylic acid Traditional Name: 1-[(4,5-dibromothiophene-2-carbonyl)amino]cycloheptanecarboxylic acid Formula: C13H15Br2NO3S MolecularWeight: 425.1361

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CC(=C(S2)Br)Br

Isomeric SMILES

C1CCCC(CC1)(C(=O)O)NC(=O)C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C13H15Br2NO3S/c14-8-7-9(20-10(8)15)11(17)16-13(12(18)19)5-3-1-2-4-6-13/h7H,1-6H2,(H,16,17)(H,18,19)