2-[1-butyl-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridin-3-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-butyl-4-(3-methoxyphenyl)-2-oxidanylidene-1,8-naphthyridin-3-yl]isoindole-1,3-dione Openeye Name: 2-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]isoindoline-1,3-dione CAS Name: 2-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]isoindole-1,3-dione IUPAC Name: 2-[1-butyl-4-(3-methoxyphenyl)-2-oxo-1,8-naphthyridin-3-yl]isoindole-1,3-dione Traditional Name: 2-[1-butyl-2-keto-4-(3-methoxyphenyl)-1,8-naphthyridin-3-yl]isoindoline-1,3-quinone Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=CC=N2)C(=C(C1=O)N3C(=O)C4=CC=CC=C4C3=O)C5=CC(=CC=C5)OC

Isomeric SMILES

CCCCN1C2=C(C=CC=N2)C(=C(C1=O)N3C(=O)C4=CC=CC=C4C3=O)C5=CC(=CC=C5)OC

InChI

InChI=1S/C27H23N3O4/c1-3-4-15-29-24-21(13-8-14-28-24)22(17-9-7-10-18(16-17)34-2)23(27(29)33)30-25(31)19-11-5-6-12-20(19)26(30)32/h5-14,16H,3-4,15H2,1-2H3