quinolin-8-ylmethyl 5-bromanylpyridine-3-carboxylate

Systemtic Name: quinolin-8-ylmethyl 5-bromanylpyridine-3-carboxylate Openeye Name: 8-quinolylmethyl 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid 8-quinolylmethyl ester Formula: C16H11BrN2O2 MolecularWeight: 343.17474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)COC(=O)C3=CC(=CN=C3)Br)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)COC(=O)C3=CC(=CN=C3)Br)N=CC=C2

InChI

InChI=1S/C16H11BrN2O2/c17-14-7-13(8-18-9-14)16(20)21-10-12-4-1-3-11-5-2-6-19-15(11)12/h1-9H,10H2