2-[2-(oxan-4-yl)ethyl]-5-(4-oxidanylidene-3,1-benzoxazin-2-yl)isoindole-1,3-dione

Systemtic Name: 2-[2-(oxan-4-yl)ethyl]-5-(4-oxidanylidene-3,1-benzoxazin-2-yl)isoindole-1,3-dione Openeye Name: 5-(4-oxo-3,1-benzoxazin-2-yl)-2-(2-tetrahydropyran-4-ylethyl)isoindoline-1,3-dione CAS Name: 2-[2-(4-oxanyl)ethyl]-5-(4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione IUPAC Name: 2-[2-(oxan-4-yl)ethyl]-5-(4-oxo-3,1-benzoxazin-2-yl)isoindole-1,3-dione Traditional Name: 5-(4-keto-3,1-benzoxazin-2-yl)-2-(2-tetrahydropyran-4-ylethyl)isoindoline-1,3-quinone Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1CCN2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1COCCC1CCN2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C23H20N2O5/c26-21-16-6-5-15(20-24-19-4-2-1-3-17(19)23(28)30-20)13-18(16)22(27)25(21)10-7-14-8-11-29-12-9-14/h1-6,13-14H,7-12H2