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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32OS/c1-22(12-7-5-9-17-26(2,3)4)13-8-6-10-18-27-25-15-11-14-23(20-25)24-16-19-28-21-24/h5,7,11,13-16,19-21H,6,8,10,12,18H2,1-4H3/b7-5+,22-13-