[(5S,7R)-3-(methylsulfanylmethoxy)-1-adamantyl] 2-methylprop-2-enoate

Systemtic Name: [(5S,7R)-3-(methylsulfanylmethoxy)-1-adamantyl] 2-methylprop-2-enoate Openeye Name: [(5S,7R)-3-(methylsulfanylmethoxy)-1-adamantyl] 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid [(5S,7R)-3-[(methylthio)methoxy]-1-adamantyl] ester IUPAC Name: [(5S,7R)-3-(methylsulfanylmethoxy)-1-adamantyl] 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid [(5S,7R)-3-[(methylthio)methoxy]-1-adamantyl] ester Formula: C16H24O3S MolecularWeight: 296.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=O)OC12CC3CC(C1)CC(C3)(C2)OCSC

Isomeric SMILES

CC(=C)C(=O)OC12C[C@@H]3C[C@H](C1)CC(C3)(C2)OCSC

InChI

InChI=1S/C16H24O3S/c1-11(2)14(17)19-16-7-12-4-13(8-16)6-15(5-12,9-16)18-10-20-3/h12-13H,1,4-10H2,2-3H3/t12-,13+,15?,16?