2-(2-methylpropyl)-5-(4-oxidanylidene-3,1-benzoxazin-2-yl)isoindole-1,3-dione

Systemtic Name: 2-(2-methylpropyl)-5-(4-oxidanylidene-3,1-benzoxazin-2-yl)isoindole-1,3-dione Openeye Name: 2-isobutyl-5-(4-oxo-3,1-benzoxazin-2-yl)isoindoline-1,3-dione CAS Name: 2-(2-methylpropyl)-5-(4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione IUPAC Name: 2-(2-methylpropyl)-5-(4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione Traditional Name: 2-isobutyl-5-(4-keto-3,1-benzoxazin-2-yl)isoindoline-1,3-quinone Formula: C20H16N2O4 MolecularWeight: 348.35204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C1=O)C=C(C=C2)C3=NC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C20H16N2O4/c1-11(2)10-22-18(23)13-8-7-12(9-15(13)19(22)24)17-21-16-6-4-3-5-14(16)20(25)26-17/h3-9,11H,10H2,1-2H3