4-(2,4,6-trinitrophenyl)iminocyclohexa-2,5-dien-1-one

Systemtic Name: 4-(2,4,6-trinitrophenyl)iminocyclohexa-2,5-dien-1-one Openeye Name: 4-(2,4,6-trinitrophenyl)iminocyclohexa-2,5-dien-1-one CAS Name: 4-(2,4,6-trinitrophenyl)imino-1-cyclohexa-2,5-dienone IUPAC Name: 4-(2,4,6-trinitrophenyl)iminocyclohexa-2,5-dien-1-one Traditional Name: 4-picryliminocyclohexa-2,5-dien-1-one Formula: C12H6N4O7 MolecularWeight: 318.19864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C=CC1=NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H6N4O7/c17-9-3-1-7(2-4-9)13-12-10(15(20)21)5-8(14(18)19)6-11(12)16(22)23/h1-6H