ethyl 3-bromanyl-4-[[(E)-but-2-enoyl]amino]benzoate

Systemtic Name: ethyl 3-bromanyl-4-[[(E)-but-2-enoyl]amino]benzoate Openeye Name: ethyl 3-bromo-4-[[(E)-but-2-enoyl]amino]benzoate CAS Name: 3-bromo-4-[[(E)-1-oxobut-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[[(E)-but-2-enoyl]amino]benzoate Traditional Name: 3-bromo-4-[[(E)-but-2-enoyl]amino]benzoic acid ethyl ester Formula: C13H14BrNO3 MolecularWeight: 312.15916

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14BrNO3/c1-3-5-12(16)15-11-7-6-9(8-10(11)14)13(17)18-4-2/h3,5-8H,4H2,1-2H3,(H,15,16)/b5-3+