7-[4-[4-(7-fluoranylisoquinolin-1-yl)piperazin-1-yl]butoxy]-1H-1,8-naphthyridin-2-one

Systemtic Name: 7-[4-[4-(7-fluoranylisoquinolin-1-yl)piperazin-1-yl]butoxy]-1H-1,8-naphthyridin-2-one Openeye Name: 7-[4-[4-(7-fluoro-1-isoquinolyl)piperazin-1-yl]butoxy]-1H-1,8-naphthyridin-2-one CAS Name: 7-[4-[4-(7-fluoro-1-isoquinolinyl)-1-piperazinyl]butoxy]-1H-1,8-naphthyridin-2-one IUPAC Name: 7-[4-[4-(7-fluoroisoquinolin-1-yl)piperazin-1-yl]butoxy]-1H-1,8-naphthyridin-2-one Traditional Name: 7-[4-[4-(7-fluoro-1-isoquinolyl)piperazino]butoxy]-1H-1,8-naphthyridin-2-one Formula: C25H26FN5O2 MolecularWeight: 447.504643

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCOC2=NC3=C(C=CC(=O)N3)C=C2)C4=NC=CC5=C4C=C(C=C5)F

Isomeric SMILES

C1CN(CCN1CCCCOC2=NC3=C(C=CC(=O)N3)C=C2)C4=NC=CC5=C4C=C(C=C5)F

InChI

InChI=1S/C25H26FN5O2/c26-20-6-3-18-9-10-27-25(21(18)17-20)31-14-12-30(13-15-31)11-1-2-16-33-23-8-5-19-4-7-22(32)28-24(19)29-23/h3-10,17H,1-2,11-16H2,(H,28,29,32)