(2E)-8-methoxy-2-(phenylmethylidene)oct-3-ynal

Systemtic Name: (2E)-8-methoxy-2-(phenylmethylidene)oct-3-ynal Openeye Name: (2E)-2-benzylidene-8-methoxy-oct-3-ynal CAS Name: (2E)-8-methoxy-2-(phenylmethylene)-3-octynal IUPAC Name: (2E)-2-benzylidene-8-methoxyoct-3-ynal Traditional Name: (2E)-2-benzal-8-methoxy-oct-3-ynal Formula: C16H18O2 MolecularWeight: 242.31292

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCC#CC(=CC1=CC=CC=C1)C=O

Isomeric SMILES

COCCCCC#C/C(=C\C1=CC=CC=C1)/C=O

InChI

InChI=1S/C16H18O2/c1-18-12-8-3-2-5-11-16(14-17)13-15-9-6-4-7-10-15/h4,6-7,9-10,13-14H,2-3,8,12H2,1H3/b16-13+