3,3-diisocyanato-1-nitro-6-phenyl-cyclohexa-1,4-diene

Systemtic Name: 3,3-diisocyanato-1-nitro-6-phenyl-cyclohexa-1,4-diene Openeye Name: 3,3-diisocyanato-1-nitro-6-phenyl-cyclohexa-1,4-diene CAS Name: 3,3-diisocyanato-1-nitro-6-phenylcyclohexa-1,4-diene IUPAC Name: 3,3-diisocyanato-1-nitro-6-phenylcyclohexa-1,4-diene Traditional Name: 3,3-diisocyanato-1-nitro-6-phenyl-cyclohexa-1,4-diene Formula: C14H9N3O4 MolecularWeight: 283.23896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=CC(C=C2[N+](=O)[O-])(N=C=O)N=C=O

Isomeric SMILES

C1=CC=C(C=C1)C2C=CC(C=C2[N+](=O)[O-])(N=C=O)N=C=O

InChI

InChI=1S/C14H9N3O4/c18-9-15-14(16-10-19)7-6-12(13(8-14)17(20)21)11-4-2-1-3-5-11/h1-8,12H