2-(7-methoxy-1,8-naphthyridin-2-yl)-3-(2-oxidanylidene-4-phenyl-butyl)-3H-isoindol-1-one

Systemtic Name: 2-(7-methoxy-1,8-naphthyridin-2-yl)-3-(2-oxidanylidene-4-phenyl-butyl)-3H-isoindol-1-one Openeye Name: 2-(7-methoxy-1,8-naphthyridin-2-yl)-3-(2-oxo-4-phenyl-butyl)isoindolin-1-one CAS Name: 2-(7-methoxy-1,8-naphthyridin-2-yl)-3-(2-oxo-4-phenylbutyl)-3H-isoindol-1-one IUPAC Name: 2-(7-methoxy-1,8-naphthyridin-2-yl)-3-(2-oxo-4-phenylbutyl)-3H-isoindol-1-one Traditional Name: 3-(2-keto-4-phenyl-butyl)-2-(7-methoxy-1,8-naphthyridin-2-yl)isoindolin-1-one Formula: C27H23N3O3 MolecularWeight: 437.48982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C=CC(=N2)N3C(C4=CC=CC=C4C3=O)CC(=O)CCC5=CC=CC=C5)C=C1

Isomeric SMILES

COC1=NC2=C(C=CC(=N2)N3C(C4=CC=CC=C4C3=O)CC(=O)CCC5=CC=CC=C5)C=C1

InChI

InChI=1S/C27H23N3O3/c1-33-25-16-13-19-12-15-24(28-26(19)29-25)30-23(21-9-5-6-10-22(21)27(30)32)17-20(31)14-11-18-7-3-2-4-8-18/h2-10,12-13,15-16,23H,11,14,17H2,1H3