3-but-3-ynyl-5-methoxy-1-phenyl-pyrazole-4-carbaldehyde

Systemtic Name: 3-but-3-ynyl-5-methoxy-1-phenyl-pyrazole-4-carbaldehyde Openeye Name: 3-but-3-ynyl-5-methoxy-1-phenyl-pyrazole-4-carbaldehyde CAS Name: 3-but-3-ynyl-5-methoxy-1-phenyl-4-pyrazolecarboxaldehyde IUPAC Name: 3-but-3-ynyl-5-methoxy-1-phenylpyrazole-4-carbaldehyde Traditional Name: 3-but-3-ynyl-5-methoxy-1-phenyl-pyrazole-4-carbaldehyde Formula: C15H14N2O2 MolecularWeight: 254.28386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=NN1C2=CC=CC=C2)CCC#C)C=O

Isomeric SMILES

COC1=C(C(=NN1C2=CC=CC=C2)CCC#C)C=O

InChI

InChI=1S/C15H14N2O2/c1-3-4-10-14-13(11-18)15(19-2)17(16-14)12-8-6-5-7-9-12/h1,5-9,11H,4,10H2,2H3