(2-bromanylpyridin-3-yl) 5-[(4-methoxy-3-oxidanyl-pyridin-2-yl)carbonylamino]pentanoate

Systemtic Name: (2-bromanylpyridin-3-yl) 5-[(4-methoxy-3-oxidanyl-pyridin-2-yl)carbonylamino]pentanoate Openeye Name: (2-bromo-3-pyridyl) 5-[(3-hydroxy-4-methoxy-pyridine-2-carbonyl)amino]pentanoate CAS Name: 5-[[(3-hydroxy-4-methoxy-2-pyridinyl)-oxomethyl]amino]pentanoic acid (2-bromo-3-pyridinyl) ester IUPAC Name: (2-bromopyridin-3-yl) 5-[(3-hydroxy-4-methoxypyridine-2-carbonyl)amino]pentanoate Traditional Name: 5-[(3-hydroxy-4-methoxy-picolinoyl)amino]valeric acid (2-bromo-3-pyridyl) ester Formula: C17H18BrN3O5 MolecularWeight: 424.24592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NC=C1)C(=O)NCCCCC(=O)OC2=C(N=CC=C2)Br)O

Isomeric SMILES

COC1=C(C(=NC=C1)C(=O)NCCCCC(=O)OC2=C(N=CC=C2)Br)O

InChI

InChI=1S/C17H18BrN3O5/c1-25-11-7-10-19-14(15(11)23)17(24)21-8-3-2-6-13(22)26-12-5-4-9-20-16(12)18/h4-5,7,9-10,23H,2-3,6,8H2,1H3,(H,21,24)