5-bromanyl-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoate

Systemtic Name: 5-bromanyl-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoate Openeye Name: 5-bromo-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoate CAS Name: 5-bromo-2-[[(E)-1-oxo-3-phenylbut-2-enyl]amino]benzoate IUPAC Name: 5-bromo-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoate Traditional Name: 5-bromo-2-[[(E)-3-phenylbut-2-enoyl]amino]benzoate Formula: C17H13BrNO3- MolecularWeight: 359.19402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=C(C=C1)Br)C(=O)[O-])C2=CC=CC=C2

Isomeric SMILES

C/C(=C\C(=O)NC1=C(C=C(C=C1)Br)C(=O)[O-])/C2=CC=CC=C2

InChI

InChI=1S/C17H14BrNO3/c1-11(12-5-3-2-4-6-12)9-16(20)19-15-8-7-13(18)10-14(15)17(21)22/h2-10H,1H3,(H,19,20)(H,21,22)/p-1/b11-9+