2-[1-tert-butyl-2-(7-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-isoindol-1-yl]ethanoate

Systemtic Name: 2-[1-tert-butyl-2-(7-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-isoindol-1-yl]ethanoate Openeye Name: 2-[1-tert-butyl-2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-isoindolin-1-yl]acetate CAS Name: 2-[1-tert-butyl-2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-1-isoindolyl]acetate IUPAC Name: 2-[1-tert-butyl-2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxoisoindol-1-yl]acetate Traditional Name: 2-[1-tert-butyl-2-(7-chloro-1,8-naphthyridin-2-yl)-3-keto-isoindolin-1-yl]acetate Formula: C22H19ClN3O3- MolecularWeight: 408.85756

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(C2=CC=CC=C2C(=O)N1C3=NC4=C(C=C3)C=CC(=N4)Cl)CC(=O)[O-]

Isomeric SMILES

CC(C)(C)C1(C2=CC=CC=C2C(=O)N1C3=NC4=C(C=C3)C=CC(=N4)Cl)CC(=O)[O-]

InChI

InChI=1S/C22H20ClN3O3/c1-21(2,3)22(12-18(27)28)15-7-5-4-6-14(15)20(29)26(22)17-11-9-13-8-10-16(23)24-19(13)25-17/h4-11H,12H2,1-3H3,(H,27,28)/p-1