6-(2-phenylethynyl)-1,3-benzodioxole-5-carbaldehyde

Systemtic Name: 6-(2-phenylethynyl)-1,3-benzodioxole-5-carbaldehyde Openeye Name: 6-(2-phenylethynyl)-1,3-benzodioxole-5-carbaldehyde CAS Name: 6-(2-phenylethynyl)-1,3-benzodioxole-5-carboxaldehyde IUPAC Name: 6-(2-phenylethynyl)-1,3-benzodioxole-5-carbaldehyde Traditional Name: 6-(2-phenylethynyl)piperonal Formula: C16H10O3 MolecularWeight: 250.2488

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=O)C#CC3=CC=CC=C3

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C=O)C#CC3=CC=CC=C3

InChI

InChI=1S/C16H10O3/c17-10-14-9-16-15(18-11-19-16)8-13(14)7-6-12-4-2-1-3-5-12/h1-5,8-10H,11H2