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

Systemtic Name: ethyl 4-[6-fluoranyl-2-(1-methylpyrrol-2-yl)quinolin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[6-fluoro-2-(1-methyl-2-pyrrolyl)-4-quinolinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[6-fluoro-2-(1-methylpyrrol-2-yl)quinoline-4-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H23FN4O3 MolecularWeight: 410.441423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)F)C4=CC=CN4C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC(=NC3=C2C=C(C=C3)F)C4=CC=CN4C

InChI

InChI=1S/C22H23FN4O3/c1-3-30-22(29)27-11-9-26(10-12-27)21(28)17-14-19(20-5-4-8-25(20)2)24-18-7-6-15(23)13-16(17)18/h4-8,13-14H,3,9-12H2,1-2H3