6-(1,3-benzodioxol-4-yl)-4-(4-fluorophenyl)-2-propan-2-yl-pyridine-3-carbaldehyde

Systemtic Name: 6-(1,3-benzodioxol-4-yl)-4-(4-fluorophenyl)-2-propan-2-yl-pyridine-3-carbaldehyde Openeye Name: 6-(1,3-benzodioxol-4-yl)-4-(4-fluorophenyl)-2-isopropyl-pyridine-3-carbaldehyde CAS Name: 6-(1,3-benzodioxol-4-yl)-4-(4-fluorophenyl)-2-propan-2-yl-3-pyridinecarboxaldehyde IUPAC Name: 6-(1,3-benzodioxol-4-yl)-4-(4-fluorophenyl)-2-propan-2-ylpyridine-3-carbaldehyde Traditional Name: 6-(1,3-benzodioxol-4-yl)-4-(4-fluorophenyl)-2-isopropyl-nicotinaldehyde Formula: C22H18FNO3 MolecularWeight: 363.381623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC(=N1)C2=C3C(=CC=C2)OCO3)C4=CC=C(C=C4)F)C=O

Isomeric SMILES

CC(C)C1=C(C(=CC(=N1)C2=C3C(=CC=C2)OCO3)C4=CC=C(C=C4)F)C=O

InChI

InChI=1S/C22H18FNO3/c1-13(2)21-18(11-25)17(14-6-8-15(23)9-7-14)10-19(24-21)16-4-3-5-20-22(16)27-12-26-20/h3-11,13H,12H2,1-2H3