2-methyl-1-[5-(7-phenoxyheptylsulfanylmethyl)furan-2-yl]propan-1-one

Systemtic Name: 2-methyl-1-[5-(7-phenoxyheptylsulfanylmethyl)furan-2-yl]propan-1-one Openeye Name: 2-methyl-1-[5-(7-phenoxyheptylsulfanylmethyl)-2-furyl]propan-1-one CAS Name: 2-methyl-1-[5-[(7-phenoxyheptylthio)methyl]-2-furanyl]-1-propanone IUPAC Name: 2-methyl-1-[5-(7-phenoxyheptylsulfanylmethyl)furan-2-yl]propan-1-one Traditional Name: 2-methyl-1-[5-[(7-phenoxyheptylthio)methyl]-2-furyl]propan-1-one Formula: C22H30O3S MolecularWeight: 374.5368

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1=CC=C(O1)CSCCCCCCCOC2=CC=CC=C2

Isomeric SMILES

CC(C)C(=O)C1=CC=C(O1)CSCCCCCCCOC2=CC=CC=C2

InChI

InChI=1S/C22H30O3S/c1-18(2)22(23)21-14-13-20(25-21)17-26-16-10-5-3-4-9-15-24-19-11-7-6-8-12-19/h6-8,11-14,18H,3-5,9-10,15-17H2,1-2H3