2-hept-1-ynyl-4-pentoxy-1-(2-phenylethynyl)benzene

Systemtic Name: 2-hept-1-ynyl-4-pentoxy-1-(2-phenylethynyl)benzene Openeye Name: 2-hept-1-ynyl-4-pentoxy-1-(2-phenylethynyl)benzene CAS Name: 2-hept-1-ynyl-4-pentoxy-1-(2-phenylethynyl)benzene IUPAC Name: 2-hept-1-ynyl-4-pentoxy-1-(2-phenylethynyl)benzene Traditional Name: 4-amoxy-2-hept-1-ynyl-1-(2-phenylethynyl)benzene Formula: C26H30O MolecularWeight: 358.5158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1=C(C=CC(=C1)OCCCCC)C#CC2=CC=CC=C2

Isomeric SMILES

CCCCCC#CC1=C(C=CC(=C1)OCCCCC)C#CC2=CC=CC=C2

InChI

InChI=1S/C26H30O/c1-3-5-7-8-12-16-25-22-26(27-21-13-6-4-2)20-19-24(25)18-17-23-14-10-9-11-15-23/h9-11,14-15,19-20,22H,3-8,13,21H2,1-2H3