(E)-3-[4-[(5-bromanylpyridin-3-yl)carbonylamino]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(5-bromanylpyridin-3-yl)carbonylamino]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[(5-bromopyridine-3-carbonyl)amino]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(5-bromopyridine-3-carbonyl)amino]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[(5-bromonicotinoyl)amino]phenyl]acrylic acid Formula: C15H11BrN2O3 MolecularWeight: 347.16344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC(=O)O)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C1=CC(=CC=C1/C=C/C(=O)O)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C15H11BrN2O3/c16-12-7-11(8-17-9-12)15(21)18-13-4-1-10(2-5-13)3-6-14(19)20/h1-9H,(H,18,21)(H,19,20)/b6-3+