5-acetamido-2-[[(E)-but-2-enoyl]amino]benzoate

Systemtic Name: 5-acetamido-2-[[(E)-but-2-enoyl]amino]benzoate Openeye Name: 5-acetamido-2-[[(E)-but-2-enoyl]amino]benzoate CAS Name: 5-acetamido-2-[[(E)-1-oxobut-2-enyl]amino]benzoate IUPAC Name: 5-acetamido-2-[[(E)-but-2-enoyl]amino]benzoate Traditional Name: 5-acetamido-2-[[(E)-but-2-enoyl]amino]benzoate Formula: C13H13N2O4- MolecularWeight: 261.25332

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)NC1=C(C=C(C=C1)NC(=O)C)C(=O)[O-]

Isomeric SMILES

C/C=C/C(=O)NC1=C(C=C(C=C1)NC(=O)C)C(=O)[O-]

InChI

InChI=1S/C13H14N2O4/c1-3-4-12(17)15-11-6-5-9(14-8(2)16)7-10(11)13(18)19/h3-7H,1-2H3,(H,14,16)(H,15,17)(H,18,19)/p-1/b4-3+