2-(2-methoxyethoxy)ethyl 5-azanyl-4-bromanyl-2-cyano-benzoate

Systemtic Name: 2-(2-methoxyethoxy)ethyl 5-azanyl-4-bromanyl-2-cyano-benzoate Openeye Name: 2-(2-methoxyethoxy)ethyl 5-amino-4-bromo-2-cyano-benzoate CAS Name: 5-amino-4-bromo-2-cyanobenzoic acid 2-(2-methoxyethoxy)ethyl ester IUPAC Name: 2-(2-methoxyethoxy)ethyl 5-amino-4-bromo-2-cyanobenzoate Traditional Name: 5-amino-4-bromo-2-cyano-benzoic acid 2-(2-methoxyethoxy)ethyl ester Formula: C13H15BrN2O4 MolecularWeight: 343.1732

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCCOC(=O)C1=CC(=C(C=C1C#N)Br)N

Isomeric SMILES

COCCOCCOC(=O)C1=CC(=C(C=C1C#N)Br)N

InChI

InChI=1S/C13H15BrN2O4/c1-18-2-3-19-4-5-20-13(17)10-7-12(16)11(14)6-9(10)8-15/h6-7H,2-5,16H2,1H3