diethyl 2-[(5-bromanylthiophen-2-yl)amino]pentanedioate

Systemtic Name: diethyl 2-[(5-bromanylthiophen-2-yl)amino]pentanedioate Openeye Name: diethyl 2-[(5-bromo-2-thienyl)amino]pentanedioate CAS Name: 2-[(5-bromo-2-thiophenyl)amino]pentanedioic acid diethyl ester IUPAC Name: diethyl 2-[(5-bromothiophen-2-yl)amino]pentanedioate Traditional Name: 2-[(5-bromo-2-thienyl)amino]glutaric acid diethyl ester Formula: C13H18BrNO4S MolecularWeight: 364.25532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(C(=O)OCC)NC1=CC=C(S1)Br

Isomeric SMILES

CCOC(=O)CCC(C(=O)OCC)NC1=CC=C(S1)Br

InChI

InChI=1S/C13H18BrNO4S/c1-3-18-12(16)8-5-9(13(17)19-4-2)15-11-7-6-10(14)20-11/h6-7,9,15H,3-5,8H2,1-2H3