2-heptyl-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-heptyl-5-nitro-isoindole-1,3-dione Openeye Name: 2-heptyl-5-nitro-isoindoline-1,3-dione CAS Name: 2-heptyl-5-nitroisoindole-1,3-dione IUPAC Name: 2-heptyl-5-nitroisoindole-1,3-dione Traditional Name: 2-heptyl-5-nitro-isoindoline-1,3-quinone Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N2O4/c1-2-3-4-5-6-9-16-14(18)12-8-7-11(17(20)21)10-13(12)15(16)19/h7-8,10H,2-6,9H2,1H3