6-phenylmethoxy-1-(phenylmethylsulfanyl)hex-4-yn-2-ol

Systemtic Name: 6-phenylmethoxy-1-(phenylmethylsulfanyl)hex-4-yn-2-ol Openeye Name: 6-benzyloxy-1-benzylsulfanyl-hex-4-yn-2-ol CAS Name: 6-phenylmethoxy-1-(phenylmethylthio)-4-hexyn-2-ol IUPAC Name: 1-benzylsulfanyl-6-phenylmethoxyhex-4-yn-2-ol Traditional Name: 6-benzoxy-1-(benzylthio)hex-4-yn-2-ol Formula: C20H22O2S MolecularWeight: 326.45248

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC#CCC(CSCC2=CC=CC=C2)O

Isomeric SMILES

C1=CC=C(C=C1)COCC#CCC(CSCC2=CC=CC=C2)O

InChI

InChI=1S/C20H22O2S/c21-20(17-23-16-19-11-5-2-6-12-19)13-7-8-14-22-15-18-9-3-1-4-10-18/h1-6,9-12,20-21H,13-17H2