6-(1H-imidazol-5-ylcarbonyl)-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde

Systemtic Name: 6-(1H-imidazol-5-ylcarbonyl)-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde Openeye Name: 6-(1H-imidazole-5-carbonyl)-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde CAS Name: 6-[1H-imidazol-5-yl(oxo)methyl]-4H-benzo[f][1,3]benzodioxole-6-carboxaldehyde IUPAC Name: 6-(1H-imidazole-5-carbonyl)-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde Traditional Name: 6-(1H-imidazole-5-carbonyl)-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde Formula: C16H12N2O4 MolecularWeight: 296.27748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(C=CC2=CC3=C1OCO3)(C=O)C(=O)C4=CN=CN4

Isomeric SMILES

C1C2=CC(C=CC2=CC3=C1OCO3)(C=O)C(=O)C4=CN=CN4

InChI

InChI=1S/C16H12N2O4/c19-7-16(15(20)12-6-17-8-18-12)2-1-10-3-13-14(22-9-21-13)4-11(10)5-16/h1-3,5-8H,4,9H2,(H,17,18)