[2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-[(4-methoxyphenyl)sulfonylamino]propanoate

Systemtic Name: [2-(5-bromanylthiophen-2-yl)-2-oxidanylidene-ethyl] 3-[(4-methoxyphenyl)sulfonylamino]propanoate Openeye Name: [2-(5-bromo-2-thienyl)-2-oxo-ethyl] 3-[(4-methoxyphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-methoxyphenyl)sulfonylamino]propanoic acid [2-(5-bromo-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-bromothiophen-2-yl)-2-oxoethyl] 3-[(4-methoxyphenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-methoxyphenyl)sulfonylamino]propionic acid [2-(5-bromo-2-thienyl)-2-keto-ethyl] ester Formula: C16H16BrNO6S2 MolecularWeight: 462.33534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)C2=CC=C(S2)Br

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)C2=CC=C(S2)Br

InChI

InChI=1S/C16H16BrNO6S2/c1-23-11-2-4-12(5-3-11)26(21,22)18-9-8-16(20)24-10-13(19)14-6-7-15(17)25-14/h2-7,18H,8-10H2,1H3