6-[[(4-chloranyl-3-nitro-phenyl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(4-chloranyl-3-nitro-phenyl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(4-chloro-3-nitro-anilino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[(4-chloro-3-nitroanilino)methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(4-chloro-3-nitroanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[(4-chloro-3-nitro-anilino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C13H8ClN3O5 MolecularWeight: 321.67272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC=C2C=C(C=CC2=O)[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=C(C=C1NC=C2C=C(C=CC2=O)[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C13H8ClN3O5/c14-11-3-1-9(6-12(11)17(21)22)15-7-8-5-10(16(19)20)2-4-13(8)18/h1-7,15H