1,2,3-trimethoxy-5-(1-phenylhex-5-en-1-yn-3-yl)benzene

Systemtic Name: 1,2,3-trimethoxy-5-(1-phenylhex-5-en-1-yn-3-yl)benzene Openeye Name: 1,2,3-trimethoxy-5-[1-(2-phenylethynyl)but-3-enyl]benzene CAS Name: 1,2,3-trimethoxy-5-(1-phenylhex-5-en-1-yn-3-yl)benzene IUPAC Name: 1,2,3-trimethoxy-5-(1-phenylhex-5-en-1-yn-3-yl)benzene Traditional Name: 1,2,3-trimethoxy-5-[1-(2-phenylethynyl)but-3-enyl]benzene Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(CC=C)C#CC2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(CC=C)C#CC2=CC=CC=C2

InChI

InChI=1S/C21H22O3/c1-5-9-17(13-12-16-10-7-6-8-11-16)18-14-19(22-2)21(24-4)20(15-18)23-3/h5-8,10-11,14-15,17H,1,9H2,2-4H3