5-bromanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid

Systemtic Name: 5-bromanyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid Openeye Name: 5-bromo-3-(tert-butoxycarbonylamino)thiophene-2-carboxylic acid CAS Name: 5-bromo-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 5-bromo-3-[(2-methylpropan-2-yl)oxycarbonylamino]thiophene-2-carboxylic acid Traditional Name: 5-bromo-3-(tert-butoxycarbonylamino)-2-thenoic acid Formula: C10H12BrNO4S MolecularWeight: 322.17558

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(SC(=C1)Br)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(SC(=C1)Br)C(=O)O

InChI

InChI=1S/C10H12BrNO4S/c1-10(2,3)16-9(15)12-5-4-6(11)17-7(5)8(13)14/h4H,1-3H3,(H,12,15)(H,13,14)