3-[4-[2-[(5-bromanyl-2-methoxy-pyridin-3-yl)carbonylamino]ethyl]phenyl]propanoic acid

Systemtic Name: 3-[4-[2-[(5-bromanyl-2-methoxy-pyridin-3-yl)carbonylamino]ethyl]phenyl]propanoic acid Openeye Name: 3-[4-[2-[(5-bromo-2-methoxy-pyridine-3-carbonyl)amino]ethyl]phenyl]propanoic acid CAS Name: 3-[4-[2-[[(5-bromo-2-methoxy-3-pyridinyl)-oxomethyl]amino]ethyl]phenyl]propanoic acid IUPAC Name: 3-[4-[2-[(5-bromo-2-methoxypyridine-3-carbonyl)amino]ethyl]phenyl]propanoic acid Traditional Name: 3-[4-[2-[(5-bromo-2-methoxy-nicotinoyl)amino]ethyl]phenyl]propionic acid Formula: C18H19BrN2O4 MolecularWeight: 407.25846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1C(=O)NCCC2=CC=C(C=C2)CCC(=O)O)Br

Isomeric SMILES

COC1=NC=C(C=C1C(=O)NCCC2=CC=C(C=C2)CCC(=O)O)Br

InChI

InChI=1S/C18H19BrN2O4/c1-25-18-15(10-14(19)11-21-18)17(24)20-9-8-13-4-2-12(3-5-13)6-7-16(22)23/h2-5,10-11H,6-9H2,1H3,(H,20,24)(H,22,23)