methyl 3-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-8-oxidanyl-quinoline-7-carboxylate

Systemtic Name: methyl 3-[(4-fluorophenyl)methyl]-5-(hydroxymethyl)-8-oxidanyl-quinoline-7-carboxylate Openeye Name: methyl 3-[(4-fluorophenyl)methyl]-8-hydroxy-5-(hydroxymethyl)quinoline-7-carboxylate CAS Name: 3-[(4-fluorophenyl)methyl]-8-hydroxy-5-(hydroxymethyl)-7-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-fluorophenyl)methyl]-8-hydroxy-5-(hydroxymethyl)quinoline-7-carboxylate Traditional Name: 3-(4-fluorobenzyl)-8-hydroxy-5-methylol-quinoline-7-carboxylic acid methyl ester Formula: C19H16FNO4 MolecularWeight: 341.333043

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=NC=C(C=C2C(=C1)CO)CC3=CC=C(C=C3)F)O

Isomeric SMILES

COC(=O)C1=C(C2=NC=C(C=C2C(=C1)CO)CC3=CC=C(C=C3)F)O

InChI

InChI=1S/C19H16FNO4/c1-25-19(24)16-8-13(10-22)15-7-12(9-21-17(15)18(16)23)6-11-2-4-14(20)5-3-11/h2-5,7-9,22-23H,6,10H2,1H3