3-(1-phenylocta-5,7-diyn-2-yl)benzaldehyde

Systemtic Name: 3-(1-phenylocta-5,7-diyn-2-yl)benzaldehyde Openeye Name: 3-(1-benzylhepta-4,6-diynyl)benzaldehyde CAS Name: 3-(1-phenylocta-5,7-diyn-2-yl)benzaldehyde IUPAC Name: 3-(1-phenylocta-5,7-diyn-2-yl)benzaldehyde Traditional Name: 3-(1-benzylhepta-4,6-diynyl)benzaldehyde Formula: C21H18O MolecularWeight: 286.36702

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Descriptors Computed from Structure

Canonical SMILES:

C#CC#CCCC(CC1=CC=CC=C1)C2=CC=CC(=C2)C=O

Isomeric SMILES

C#CC#CCCC(CC1=CC=CC=C1)C2=CC=CC(=C2)C=O

InChI

InChI=1S/C21H18O/c1-2-3-4-8-13-20(15-18-10-6-5-7-11-18)21-14-9-12-19(16-21)17-22/h1,5-7,9-12,14,16-17,20H,8,13,15H2