2-(7-methoxy-1,8-naphthyridin-2-yl)-3-(5-oxidanyl-2-oxidanylidene-pentyl)-3H-isoindol-1-one

Systemtic Name: 2-(7-methoxy-1,8-naphthyridin-2-yl)-3-(5-oxidanyl-2-oxidanylidene-pentyl)-3H-isoindol-1-one Openeye Name: 3-(5-hydroxy-2-oxo-pentyl)-2-(7-methoxy-1,8-naphthyridin-2-yl)isoindolin-1-one CAS Name: 3-(5-hydroxy-2-oxopentyl)-2-(7-methoxy-1,8-naphthyridin-2-yl)-3H-isoindol-1-one IUPAC Name: 3-(5-hydroxy-2-oxopentyl)-2-(7-methoxy-1,8-naphthyridin-2-yl)-3H-isoindol-1-one Traditional Name: 3-(5-hydroxy-2-keto-pentyl)-2-(7-methoxy-1,8-naphthyridin-2-yl)isoindolin-1-one Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C=CC(=N2)N3C(C4=CC=CC=C4C3=O)CC(=O)CCCO)C=C1

Isomeric SMILES

COC1=NC2=C(C=CC(=N2)N3C(C4=CC=CC=C4C3=O)CC(=O)CCCO)C=C1

InChI

InChI=1S/C22H21N3O4/c1-29-20-11-9-14-8-10-19(23-21(14)24-20)25-18(13-15(27)5-4-12-26)16-6-2-3-7-17(16)22(25)28/h2-3,6-11,18,26H,4-5,12-13H2,1H3