2-butoxy-4-(2-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridine-3-carbaldehyde

Systemtic Name: 2-butoxy-4-(2-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridine-3-carbaldehyde Openeye Name: 2-butoxy-4-(2-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridine-3-carbaldehyde CAS Name: 2-butoxy-4-(2-fluorophenyl)-5-(4-methylsulfonylphenyl)-3-pyridinecarboxaldehyde IUPAC Name: 2-butoxy-4-(2-fluorophenyl)-5-(4-methylsulfonylphenyl)pyridine-3-carbaldehyde Traditional Name: 2-butoxy-4-(2-fluorophenyl)-5-(4-mesylphenyl)nicotinaldehyde Formula: C23H22FNO4S MolecularWeight: 427.488483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=NC=C(C(=C1C=O)C2=CC=CC=C2F)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCOC1=NC=C(C(=C1C=O)C2=CC=CC=C2F)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C23H22FNO4S/c1-3-4-13-29-23-20(15-26)22(18-7-5-6-8-21(18)24)19(14-25-23)16-9-11-17(12-10-16)30(2,27)28/h5-12,14-15H,3-4,13H2,1-2H3