6-[[(5-chloranyl-1,3-benzoxazol-2-yl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(5-chloranyl-1,3-benzoxazol-2-yl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(5-chloro-1,3-benzoxazol-2-yl)amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[(5-chloro-1,3-benzoxazol-2-yl)amino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(5-chloro-1,3-benzoxazol-2-yl)amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[(5-chloro-1,3-benzoxazol-2-yl)amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C14H8ClN3O4 MolecularWeight: 317.68402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CNC2=NC3=C(O2)C=CC(=C3)Cl)C=C1[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C(=CNC2=NC3=C(O2)C=CC(=C3)Cl)C=C1[N+](=O)[O-]

InChI

InChI=1S/C14H8ClN3O4/c15-9-1-4-13-11(6-9)17-14(22-13)16-7-8-5-10(18(20)21)2-3-12(8)19/h1-7H,(H,16,17)