[(2E,6E)-7,11-dimethyl-1-phenylmethoxy-dodeca-2,6,10-trien-5-yl]sulfanylbenzene

Systemtic Name: [(2E,6E)-7,11-dimethyl-1-phenylmethoxy-dodeca-2,6,10-trien-5-yl]sulfanylbenzene Openeye Name: [(2E)-1-[(E)-4-benzyloxybut-2-enyl]-3,7-dimethyl-octa-2,6-dienyl]sulfanylbenzene CAS Name: [[(2E,6E)-7,11-dimethyl-1-phenylmethoxydodeca-2,6,10-trien-5-yl]thio]benzene IUPAC Name: [(2E,6E)-7,11-dimethyl-1-phenylmethoxydodeca-2,6,10-trien-5-yl]sulfanylbenzene Traditional Name: [[(2E)-1-[(E)-4-benzoxybut-2-enyl]-3,7-dimethyl-octa-2,6-dienyl]thio]benzene Formula: C27H34OS MolecularWeight: 406.62326

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CC(CC=CCOCC1=CC=CC=C1)SC2=CC=CC=C2)C)C

Isomeric SMILES

CC(=CCC/C(=C/C(C/C=C/COCC1=CC=CC=C1)SC2=CC=CC=C2)/C)C

InChI

InChI=1S/C27H34OS/c1-23(2)13-12-14-24(3)21-27(29-26-17-8-5-9-18-26)19-10-11-20-28-22-25-15-6-4-7-16-25/h4-11,13,15-18,21,27H,12,14,19-20,22H2,1-3H3/b11-10+,24-21+