methyl 2-[(4-bromanyl-2-thiophen-2-yl-phenyl)carbonylamino]hexanoate

Systemtic Name: methyl 2-[(4-bromanyl-2-thiophen-2-yl-phenyl)carbonylamino]hexanoate Openeye Name: methyl 2-[[4-bromo-2-(2-thienyl)benzoyl]amino]hexanoate CAS Name: 2-[[(4-bromo-2-thiophen-2-ylphenyl)-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 2-[(4-bromo-2-thiophen-2-ylbenzoyl)amino]hexanoate Traditional Name: 2-[[4-bromo-2-(2-thienyl)benzoyl]amino]hexanoic acid methyl ester Formula: C18H20BrNO3S MolecularWeight: 410.3253

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)OC)NC(=O)C1=C(C=C(C=C1)Br)C2=CC=CS2

Isomeric SMILES

CCCCC(C(=O)OC)NC(=O)C1=C(C=C(C=C1)Br)C2=CC=CS2

InChI

InChI=1S/C18H20BrNO3S/c1-3-4-6-15(18(22)23-2)20-17(21)13-9-8-12(19)11-14(13)16-7-5-10-24-16/h5,7-11,15H,3-4,6H2,1-2H3,(H,20,21)