ethyl 1-[6-fluoranyl-2-(1-methylpyrrol-2-yl)quinolin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[6-fluoranyl-2-(1-methylpyrrol-2-yl)quinolin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[6-fluoro-2-(1-methyl-2-pyrrolyl)-4-quinolinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carbonyl]nipecotic acid ethyl ester Formula: C23H24FN3O3 MolecularWeight: 409.453363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NC3=C2C=C(C=C3)F)C4=CC=CN4C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=NC3=C2C=C(C=C3)F)C4=CC=CN4C

InChI

InChI=1S/C23H24FN3O3/c1-3-30-23(29)15-6-4-11-27(14-15)22(28)18-13-20(21-7-5-10-26(21)2)25-19-9-8-16(24)12-17(18)19/h5,7-10,12-13,15H,3-4,6,11,14H2,1-2H3