5-hexoxy-3-methyl-1-phenyl-pyrazole-4-carbaldehyde

Systemtic Name: 5-hexoxy-3-methyl-1-phenyl-pyrazole-4-carbaldehyde Openeye Name: 5-hexoxy-3-methyl-1-phenyl-pyrazole-4-carbaldehyde CAS Name: 5-hexoxy-3-methyl-1-phenyl-4-pyrazolecarboxaldehyde IUPAC Name: 5-hexoxy-3-methyl-1-phenylpyrazole-4-carbaldehyde Traditional Name: 5-hexoxy-3-methyl-1-phenyl-pyrazole-4-carbaldehyde Formula: C17H22N2O2 MolecularWeight: 286.36878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C(=NN1C2=CC=CC=C2)C)C=O

Isomeric SMILES

CCCCCCOC1=C(C(=NN1C2=CC=CC=C2)C)C=O

InChI

InChI=1S/C17H22N2O2/c1-3-4-5-9-12-21-17-16(13-20)14(2)18-19(17)15-10-7-6-8-11-15/h6-8,10-11,13H,3-5,9,12H2,1-2H3