4-[5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C14H10N4O3 MolecularWeight: 282.2542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=C2NNC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=O)C=CC1=C2NNC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O3/c19-12-7-3-10(4-8-12)14-15-13(16-17-14)9-1-5-11(6-2-9)18(20)21/h1-8,17H,(H,15,16)