2-phenyl-3-[(5Z,8E)-6,12,12-trimethyltrideca-5,8-dien-10-ynoxy]thiophene

Systemtic Name: 2-phenyl-3-[(5Z,8E)-6,12,12-trimethyltrideca-5,8-dien-10-ynoxy]thiophene Openeye Name: 2-phenyl-3-[(5Z,8E)-6,12,12-trimethyltrideca-5,8-dien-10-ynoxy]thiophene CAS Name: 2-phenyl-3-[(5Z,8E)-6,12,12-trimethyltrideca-5,8-dien-10-ynoxy]thiophene IUPAC Name: 2-phenyl-3-[(5Z,8E)-6,12,12-trimethyltrideca-5,8-dien-10-ynoxy]thiophene Traditional Name: 2-phenyl-3-[(5Z,8E)-6,12,12-trimethyltrideca-5,8-dien-10-ynoxy]thiophene Formula: C26H32OS MolecularWeight: 392.59668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCCCOC1=C(SC=C1)C2=CC=CC=C2)CC=CC#CC(C)(C)C

Isomeric SMILES

C/C(=C/CCCCOC1=C(SC=C1)C2=CC=CC=C2)/C/C=C/C#CC(C)(C)C

InChI

InChI=1S/C26H32OS/c1-22(14-8-6-12-19-26(2,3)4)15-9-7-13-20-27-24-18-21-28-25(24)23-16-10-5-11-17-23/h5-6,8,10-11,15-18,21H,7,9,13-14,20H2,1-4H3/b8-6+,22-15-