ethyl 3-bromanyl-4-[2-(2-methoxyethylsulfanyl)ethanoylamino]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[2-(2-methoxyethylsulfanyl)ethanoylamino]benzoate Openeye Name: ethyl 3-bromo-4-[[2-(2-methoxyethylsulfanyl)acetyl]amino]benzoate CAS Name: 3-bromo-4-[[2-(2-methoxyethylthio)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[[2-(2-methoxyethylsulfanyl)acetyl]amino]benzoate Traditional Name: 3-bromo-4-[[2-(2-methoxyethylthio)acetyl]amino]benzoic acid ethyl ester Formula: C14H18BrNO4S MolecularWeight: 376.26602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CSCCOC)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)NC(=O)CSCCOC)Br

InChI

InChI=1S/C14H18BrNO4S/c1-3-20-14(18)10-4-5-12(11(15)8-10)16-13(17)9-21-7-6-19-2/h4-5,8H,3,6-7,9H2,1-2H3,(H,16,17)