methyl 2-[3-[2-(7-bromanylquinolin-2-yl)ethynyl]phenoxy]propanoate

Systemtic Name: methyl 2-[3-[2-(7-bromanylquinolin-2-yl)ethynyl]phenoxy]propanoate Openeye Name: methyl 2-[3-[2-(7-bromo-2-quinolyl)ethynyl]phenoxy]propanoate CAS Name: 2-[3-[2-(7-bromo-2-quinolinyl)ethynyl]phenoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[3-[2-(7-bromoquinolin-2-yl)ethynyl]phenoxy]propanoate Traditional Name: 2-[3-[2-(7-bromo-2-quinolyl)ethynyl]phenoxy]propionic acid methyl ester Formula: C21H16BrNO3 MolecularWeight: 410.26064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=CC=CC(=C1)C#CC2=NC3=C(C=CC(=C3)Br)C=C2

Isomeric SMILES

CC(C(=O)OC)OC1=CC=CC(=C1)C#CC2=NC3=C(C=CC(=C3)Br)C=C2

InChI

InChI=1S/C21H16BrNO3/c1-14(21(24)25-2)26-19-5-3-4-15(12-19)6-10-18-11-8-16-7-9-17(22)13-20(16)23-18/h3-5,7-9,11-14H,1-2H3