5-isocyanoisoindole-1,3-dione

Systemtic Name: 5-isocyanoisoindole-1,3-dione Openeye Name: 5-isocyanoisoindoline-1,3-dione CAS Name: 5-isocyanoisoindole-1,3-dione IUPAC Name: 5-isocyanoisoindole-1,3-dione Traditional Name: 5-isocyanoisoindoline-1,3-quinone Formula: C9H4N2O2 MolecularWeight: 172.14026

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC2=C(C=C1)C(=O)NC2=O

Isomeric SMILES

[C-]#[N+]C1=CC2=C(C=C1)C(=O)NC2=O

InChI

InChI=1S/C9H4N2O2/c1-10-5-2-3-6-7(4-5)9(13)11-8(6)12/h2-4H,(H,11,12,13)