6-[1-(1H-imidazol-5-yl)-2-methyl-1-oxidanyl-propyl]-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde

Systemtic Name: 6-[1-(1H-imidazol-5-yl)-2-methyl-1-oxidanyl-propyl]-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde Openeye Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methyl-propyl]-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde CAS Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methylpropyl]-4H-benzo[f][1,3]benzodioxole-6-carboxaldehyde IUPAC Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methylpropyl]-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde Traditional Name: 6-[1-hydroxy-1-(1H-imidazol-5-yl)-2-methyl-propyl]-4H-benzo[f][1,3]benzodioxole-6-carbaldehyde Formula: C19H20N2O4 MolecularWeight: 340.3731

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CN=CN1)(C2(C=CC3=CC4=C(CC3=C2)OCO4)C=O)O

Isomeric SMILES

CC(C)C(C1=CN=CN1)(C2(C=CC3=CC4=C(CC3=C2)OCO4)C=O)O

InChI

InChI=1S/C19H20N2O4/c1-12(2)19(23,17-8-20-10-21-17)18(9-22)4-3-13-5-15-16(25-11-24-15)6-14(13)7-18/h3-5,7-10,12,23H,6,11H2,1-2H3,(H,20,21)