7-(2-methyl-1,3-dioxolan-2-yl)-1-[4-methyl-2-(phenylsulfanylmethyl)furan-3-yl]hept-3-yne-1,2-diol

Systemtic Name: 7-(2-methyl-1,3-dioxolan-2-yl)-1-[4-methyl-2-(phenylsulfanylmethyl)furan-3-yl]hept-3-yne-1,2-diol Openeye Name: 7-(2-methyl-1,3-dioxolan-2-yl)-1-[4-methyl-2-(phenylsulfanylmethyl)-3-furyl]hept-3-yne-1,2-diol CAS Name: 7-(2-methyl-1,3-dioxolan-2-yl)-1-[4-methyl-2-[(phenylthio)methyl]-3-furanyl]-3-heptyne-1,2-diol IUPAC Name: 7-(2-methyl-1,3-dioxolan-2-yl)-1-[4-methyl-2-(phenylsulfanylmethyl)furan-3-yl]hept-3-yne-1,2-diol Traditional Name: 7-(2-methyl-1,3-dioxolan-2-yl)-1-[4-methyl-2-[(phenylthio)methyl]-3-furyl]hept-3-yne-1,2-diol Formula: C23H28O5S MolecularWeight: 416.53042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC(=C1C(C(C#CCCCC2(OCCO2)C)O)O)CSC3=CC=CC=C3

Isomeric SMILES

CC1=COC(=C1C(C(C#CCCCC2(OCCO2)C)O)O)CSC3=CC=CC=C3

InChI

InChI=1S/C23H28O5S/c1-17-15-26-20(16-29-18-9-5-3-6-10-18)21(17)22(25)19(24)11-7-4-8-12-23(2)27-13-14-28-23/h3,5-6,9-10,15,19,22,24-25H,4,8,12-14,16H2,1-2H3