5-[7-(1-adamantyl)-6-[tert-butyl(dimethyl)silyl]oxy-naphthalen-2-yl]thiophene-3-carboxylate

Systemtic Name: 5-[7-(1-adamantyl)-6-[tert-butyl(dimethyl)silyl]oxy-naphthalen-2-yl]thiophene-3-carboxylate Openeye Name: 5-[7-(1-adamantyl)-6-[tert-butyl(dimethyl)silyl]oxy-2-naphthyl]thiophene-3-carboxylate CAS Name: 5-[7-(1-adamantyl)-6-[tert-butyl(dimethyl)silyl]oxy-2-naphthalenyl]-3-thiophenecarboxylate IUPAC Name: 5-[7-(1-adamantyl)-6-[tert-butyl(dimethyl)silyl]oxynaphthalen-2-yl]thiophene-3-carboxylate Traditional Name: 5-[7-(1-adamantyl)-6-[tert-butyl(dimethyl)silyl]oxy-2-naphthyl]-3-thenoate Formula: C31H37O3SSi- MolecularWeight: 517.77418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[Si](C)(C)OC1=C(C=C2C=C(C=CC2=C1)C3=CC(=CS3)C(=O)[O-])C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC(C)(C)[Si](C)(C)OC1=C(C=C2C=C(C=CC2=C1)C3=CC(=CS3)C(=O)[O-])C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C31H38O3SSi/c1-30(2,3)36(4,5)34-27-13-22-6-7-23(28-14-25(18-35-28)29(32)33)11-24(22)12-26(27)31-15-19-8-20(16-31)10-21(9-19)17-31/h6-7,11-14,18-21H,8-10,15-17H2,1-5H3,(H,32,33)/p-1