1-methoxy-4-[(2E)-8-methoxy-1-[(2-methylpropan-2-yl)oxy]-2-(4-phenylsulfanylbut-2-ynylidene)oct-3-ynyl]benzene

Systemtic Name: 1-methoxy-4-[(2E)-8-methoxy-1-[(2-methylpropan-2-yl)oxy]-2-(4-phenylsulfanylbut-2-ynylidene)oct-3-ynyl]benzene Openeye Name: 1-[(2E)-1-tert-butoxy-8-methoxy-2-(4-phenylsulfanylbut-2-ynylidene)oct-3-ynyl]-4-methoxy-benzene CAS Name: 1-methoxy-4-[(2E)-8-methoxy-1-[(2-methylpropan-2-yl)oxy]-2-[4-(phenylthio)but-2-ynylidene]oct-3-ynyl]benzene IUPAC Name: 1-methoxy-4-[(2E)-8-methoxy-1-[(2-methylpropan-2-yl)oxy]-2-(4-phenylsulfanylbut-2-ynylidene)oct-3-ynyl]benzene Traditional Name: 1-[(E)-1-tert-butoxy-2-(6-methoxyhex-1-ynyl)-6-(phenylthio)hex-2-en-4-ynyl]-4-methoxy-benzene Formula: C30H36O3S MolecularWeight: 476.67004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(C1=CC=C(C=C1)OC)C(=CC#CCSC2=CC=CC=C2)C#CCCCCOC

Isomeric SMILES

CC(C)(C)OC(C1=CC=C(C=C1)OC)/C(=C/C#CCSC2=CC=CC=C2)/C#CCCCCOC

InChI

InChI=1S/C30H36O3S/c1-30(2,3)33-29(26-19-21-27(32-5)22-20-26)25(15-9-6-7-13-23-31-4)16-12-14-24-34-28-17-10-8-11-18-28/h8,10-11,16-22,29H,6-7,13,23-24H2,1-5H3/b25-16+