tert-butyl 3-phenylsulfanyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate

Systemtic Name: tert-butyl 3-phenylsulfanyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate Openeye Name: tert-butyl 3-phenylsulfanyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate CAS Name: 3-(phenylthio)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-phenylsulfanyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate Traditional Name: 3-(phenylthio)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propionic acid tert-butyl ester Formula: C19H29BO4S MolecularWeight: 364.30716

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC(C(O1)(C)C)(C)C)C(CC(=O)OC(C)(C)C)SC2=CC=CC=C2

Isomeric SMILES

B1(OC(C(O1)(C)C)(C)C)C(CC(=O)OC(C)(C)C)SC2=CC=CC=C2

InChI

InChI=1S/C19H29BO4S/c1-17(2,3)22-16(21)13-15(25-14-11-9-8-10-12-14)20-23-18(4,5)19(6,7)24-20/h8-12,15H,13H2,1-7H3