5-nitro-2-(oxan-2-ylmethyl)isoindole-1,3-dione

Systemtic Name: 5-nitro-2-(oxan-2-ylmethyl)isoindole-1,3-dione Openeye Name: 5-nitro-2-(tetrahydropyran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 5-nitro-2-(2-oxanylmethyl)isoindole-1,3-dione IUPAC Name: 5-nitro-2-(oxan-2-ylmethyl)isoindole-1,3-dione Traditional Name: 5-nitro-2-(tetrahydropyran-2-ylmethyl)isoindoline-1,3-quinone Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCOC(C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O5/c17-13-11-5-4-9(16(19)20)7-12(11)14(18)15(13)8-10-3-1-2-6-21-10/h4-5,7,10H,1-3,6,8H2