methyl 5-bromanyl-6-oxidanyl-8-(piperidin-1-ylmethyl)quinoline-4-carboxylate

Systemtic Name: methyl 5-bromanyl-6-oxidanyl-8-(piperidin-1-ylmethyl)quinoline-4-carboxylate Openeye Name: methyl 5-bromo-6-hydroxy-8-(1-piperidylmethyl)quinoline-4-carboxylate CAS Name: 5-bromo-6-hydroxy-8-(1-piperidinylmethyl)-4-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 5-bromo-6-hydroxy-8-(piperidin-1-ylmethyl)quinoline-4-carboxylate Traditional Name: 5-bromo-6-hydroxy-8-(piperidinomethyl)cinchoninic acid methyl ester Formula: C17H19BrN2O3 MolecularWeight: 379.24836

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C2C(=C(C=C(C2=NC=C1)CN3CCCCC3)O)Br

Isomeric SMILES

COC(=O)C1=C2C(=C(C=C(C2=NC=C1)CN3CCCCC3)O)Br

InChI

InChI=1S/C17H19BrN2O3/c1-23-17(22)12-5-6-19-16-11(9-13(21)15(18)14(12)16)10-20-7-3-2-4-8-20/h5-6,9,21H,2-4,7-8,10H2,1H3