(7-fluoranyl-2-methyl-quinolin-3-yl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone

Systemtic Name: (7-fluoranyl-2-methyl-quinolin-3-yl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone Openeye Name: (7-fluoro-2-methyl-3-quinolyl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone CAS Name: (7-fluoro-2-methyl-3-quinolinyl)-[2-(1-methyl-2-pyrrolyl)-1-azepanyl]methanone IUPAC Name: (7-fluoro-2-methylquinolin-3-yl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone Traditional Name: (7-fluoro-2-methyl-3-quinolyl)-[2-(1-methylpyrrol-2-yl)azepan-1-yl]methanone Formula: C22H24FN3O MolecularWeight: 365.443863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N3CCCCCC3C4=CC=CN4C

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N3CCCCCC3C4=CC=CN4C

InChI

InChI=1S/C22H24FN3O/c1-15-18(13-16-9-10-17(23)14-19(16)24-15)22(27)26-12-5-3-4-7-21(26)20-8-6-11-25(20)2/h6,8-11,13-14,21H,3-5,7,12H2,1-2H3