methyl 4-[(5-bromanylthiophen-2-yl)sulfonylamino]-2-methoxy-benzoate

Systemtic Name: methyl 4-[(5-bromanylthiophen-2-yl)sulfonylamino]-2-methoxy-benzoate Openeye Name: methyl 4-[(5-bromo-2-thienyl)sulfonylamino]-2-methoxy-benzoate CAS Name: 4-[(5-bromo-2-thiophenyl)sulfonylamino]-2-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[(5-bromothiophen-2-yl)sulfonylamino]-2-methoxybenzoate Traditional Name: 4-[(5-bromo-2-thienyl)sulfonylamino]-2-methoxy-benzoic acid methyl ester Formula: C13H12BrNO5S2 MolecularWeight: 406.27208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NS(=O)(=O)C2=CC=C(S2)Br)C(=O)OC

Isomeric SMILES

COC1=C(C=CC(=C1)NS(=O)(=O)C2=CC=C(S2)Br)C(=O)OC

InChI

InChI=1S/C13H12BrNO5S2/c1-19-10-7-8(3-4-9(10)13(16)20-2)15-22(17,18)12-6-5-11(14)21-12/h3-7,15H,1-2H3