tert-butyl 2-[1-[[8a-(phenylmethylsulfanyl)-1,2,3,4,5,6,7,8-octahydronaphthalen-4a-yl]oxy]-3-methoxy-propan-2-yl]oxyethanoate

Systemtic Name: tert-butyl 2-[1-[[8a-(phenylmethylsulfanyl)-1,2,3,4,5,6,7,8-octahydronaphthalen-4a-yl]oxy]-3-methoxy-propan-2-yl]oxyethanoate Openeye Name: tert-butyl 2-[1-[(8a-benzylsulfanyldecalin-4a-yl)oxymethyl]-2-methoxy-ethoxy]acetate CAS Name: 2-[1-[[8a-(phenylmethylthio)-1,2,3,4,5,6,7,8-octahydronaphthalen-4a-yl]oxy]-3-methoxypropan-2-yl]oxyacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[1-[(8a-benzylsulfanyl-1,2,3,4,5,6,7,8-octahydronaphthalen-4a-yl)oxy]-3-methoxypropan-2-yl]oxyacetate Traditional Name: 2-[1-[[8a-(benzylthio)decalin-4a-yl]oxymethyl]-2-methoxy-ethoxy]acetic acid tert-butyl ester Formula: C27H42O5S MolecularWeight: 478.68438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC(COC)COC12CCCCC1(CCCC2)SCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)COC(COC)COC12CCCCC1(CCCC2)SCC3=CC=CC=C3

InChI

InChI=1S/C27H42O5S/c1-25(2,3)32-24(28)20-30-23(18-29-4)19-31-26-14-8-10-16-27(26,17-11-9-15-26)33-21-22-12-6-5-7-13-22/h5-7,12-13,23H,8-11,14-21H2,1-4H3