2-[(4Z,8Z)-12-phenylsulfanyldodeca-4,8-dien-2,6,10-triynoxy]oxane

Systemtic Name: 2-[(4Z,8Z)-12-phenylsulfanyldodeca-4,8-dien-2,6,10-triynoxy]oxane Openeye Name: 2-[(4Z,8Z)-12-phenylsulfanyldodeca-4,8-dien-2,6,10-triynoxy]tetrahydropyran CAS Name: 2-[(4Z,8Z)-12-(phenylthio)dodeca-4,8-dien-2,6,10-triynoxy]oxane IUPAC Name: 2-[(4Z,8Z)-12-phenylsulfanyldodeca-4,8-dien-2,6,10-triynoxy]oxane Traditional Name: 2-[(4Z,8Z)-12-(phenylthio)dodeca-4,8-dien-2,6,10-triynoxy]tetrahydropyran Formula: C23H22O2S MolecularWeight: 362.48458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCC#CC=CC#CC=CC#CCSC2=CC=CC=C2

Isomeric SMILES

C1CCOC(C1)OCC#C/C=C\C#C/C=C\C#CCSC2=CC=CC=C2

InChI

InChI=1S/C23H22O2S/c1(3-5-7-13-19-24-23-18-12-14-20-25-23)2-4-6-8-15-21-26-22-16-10-9-11-17-22/h3-6,9-11,16-17,23H,12,14,18-21H2/b5-3-,6-4-