3-[2-(3-methylbutan-2-yl)-1-oxidanylidene-3H-isoindol-4-yl]-1H-quinoxalin-2-one

Systemtic Name: 3-[2-(3-methylbutan-2-yl)-1-oxidanylidene-3H-isoindol-4-yl]-1H-quinoxalin-2-one Openeye Name: 3-[2-(1,2-dimethylpropyl)-1-oxo-isoindolin-4-yl]-1H-quinoxalin-2-one CAS Name: 3-[2-(3-methylbutan-2-yl)-1-oxo-3H-isoindol-4-yl]-1H-quinoxalin-2-one IUPAC Name: 3-[2-(3-methylbutan-2-yl)-1-oxo-3H-isoindol-4-yl]-1H-quinoxalin-2-one Traditional Name: 3-[2-(1,2-dimethylpropyl)-1-keto-isoindolin-4-yl]-1H-quinoxalin-2-one Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)N1CC2=C(C=CC=C2C1=O)C3=NC4=CC=CC=C4NC3=O

Isomeric SMILES

CC(C)C(C)N1CC2=C(C=CC=C2C1=O)C3=NC4=CC=CC=C4NC3=O

InChI

InChI=1S/C21H21N3O2/c1-12(2)13(3)24-11-16-14(7-6-8-15(16)21(24)26)19-20(25)23-18-10-5-4-9-17(18)22-19/h4-10,12-13H,11H2,1-3H3,(H,23,25)