2-(3-methyl-4-octoxy-phenyl)pyridine-3-carbaldehyde

Systemtic Name: 2-(3-methyl-4-octoxy-phenyl)pyridine-3-carbaldehyde Openeye Name: 2-(3-methyl-4-octoxy-phenyl)pyridine-3-carbaldehyde CAS Name: 2-(3-methyl-4-octoxyphenyl)-3-pyridinecarboxaldehyde IUPAC Name: 2-(3-methyl-4-octoxyphenyl)pyridine-3-carbaldehyde Traditional Name: 2-(3-methyl-4-octoxy-phenyl)nicotinaldehyde Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C2=C(C=CC=N2)C=O)C

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C2=C(C=CC=N2)C=O)C

InChI

InChI=1S/C21H27NO2/c1-3-4-5-6-7-8-14-24-20-12-11-18(15-17(20)2)21-19(16-23)10-9-13-22-21/h9-13,15-16H,3-8,14H2,1-2H3