2-chloranyl-3-(5-methyl-2-oxidanylidene-hexyl)-7-(1,8-naphthyridin-2-yl)-3H-isoindol-1-one

Systemtic Name: 2-chloranyl-3-(5-methyl-2-oxidanylidene-hexyl)-7-(1,8-naphthyridin-2-yl)-3H-isoindol-1-one Openeye Name: 2-chloro-3-(5-methyl-2-oxo-hexyl)-7-(1,8-naphthyridin-2-yl)isoindolin-1-one CAS Name: 2-chloro-3-(5-methyl-2-oxohexyl)-7-(1,8-naphthyridin-2-yl)-3H-isoindol-1-one IUPAC Name: 2-chloro-3-(5-methyl-2-oxohexyl)-7-(1,8-naphthyridin-2-yl)-3H-isoindol-1-one Traditional Name: 2-chloro-3-(2-keto-5-methyl-hexyl)-7-(1,8-naphthyridin-2-yl)isoindolin-1-one Formula: C23H22ClN3O2 MolecularWeight: 407.89268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)CC1C2=CC=CC(=C2C(=O)N1Cl)C3=NC4=C(C=CC=N4)C=C3

Isomeric SMILES

CC(C)CCC(=O)CC1C2=CC=CC(=C2C(=O)N1Cl)C3=NC4=C(C=CC=N4)C=C3

InChI

InChI=1S/C23H22ClN3O2/c1-14(2)8-10-16(28)13-20-18-7-3-6-17(21(18)23(29)27(20)24)19-11-9-15-5-4-12-25-22(15)26-19/h3-7,9,11-12,14,20H,8,10,13H2,1-2H3