cyanomethyl 6-bromanyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: cyanomethyl 6-bromanyl-2-phenyl-quinoline-4-carboxylate Openeye Name: cyanomethyl 6-bromo-2-phenyl-quinoline-4-carboxylate CAS Name: 6-bromo-2-phenyl-4-quinolinecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 6-bromo-2-phenylquinoline-4-carboxylate Traditional Name: 6-bromo-2-phenyl-cinchoninic acid cyanomethyl ester Formula: C18H11BrN2O2 MolecularWeight: 367.19614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)OCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)OCC#N

InChI

InChI=1S/C18H11BrN2O2/c19-13-6-7-16-14(10-13)15(18(22)23-9-8-20)11-17(21-16)12-4-2-1-3-5-12/h1-7,10-11H,9H2