[2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-naphthalen-2-ylsulfanylethanoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-naphthalen-2-ylsulfanylethanoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2-(2-naphthylsulfanyl)acetate CAS Name: 2-(2-naphthalenylthio)acetic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2-naphthalen-2-ylsulfanylacetate Traditional Name: 2-(2-naphthylthio)acetic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C24H26O3S MolecularWeight: 394.52644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CSC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)COC(=O)CSC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C24H26O3S/c25-22(24-11-16-7-17(12-24)9-18(8-16)13-24)14-27-23(26)15-28-21-6-5-19-3-1-2-4-20(19)10-21/h1-6,10,16-18H,7-9,11-15H2