(3S)-3-[[7-fluoranyl-2-(3-methoxyphenyl)quinolin-3-yl]methylamino]azepan-2-one

Systemtic Name: (3S)-3-[[7-fluoranyl-2-(3-methoxyphenyl)quinolin-3-yl]methylamino]azepan-2-one Openeye Name: (3S)-3-[[7-fluoro-2-(3-methoxyphenyl)-3-quinolyl]methylamino]azepan-2-one CAS Name: (3S)-3-[[7-fluoro-2-(3-methoxyphenyl)-3-quinolinyl]methylamino]-2-azepanone IUPAC Name: (3S)-3-[[7-fluoro-2-(3-methoxyphenyl)quinolin-3-yl]methylamino]azepan-2-one Traditional Name: (3S)-3-[[7-fluoro-2-(3-methoxyphenyl)-3-quinolyl]methylamino]azepan-2-one Formula: C23H24FN3O2 MolecularWeight: 393.453963

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C=C3C=CC(=CC3=N2)F)CNC4CCCCNC4=O

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C=C3C=CC(=CC3=N2)F)CN[C@H]4CCCCNC4=O

InChI

InChI=1S/C23H24FN3O2/c1-29-19-6-4-5-16(12-19)22-17(11-15-8-9-18(24)13-21(15)27-22)14-26-20-7-2-3-10-25-23(20)28/h4-6,8-9,11-13,20,26H,2-3,7,10,14H2,1H3,(H,25,28)/t20-/m0/s1