O4-(1,3-benzoxazol-2-ylsulfanyl) O1-tert-butyl 2-tert-butylbutanedioate

Systemtic Name: O4-(1,3-benzoxazol-2-ylsulfanyl) O1-tert-butyl 2-tert-butylbutanedioate Openeye Name: O4-(1,3-benzoxazol-2-ylsulfanyl) O1-tert-butyl 2-tert-butylbutanedioate CAS Name: 2-tert-butylbutanedioic acid O4-(1,3-benzoxazol-2-ylthio) ester O1-tert-butyl ester IUPAC Name: 4-O-(1,3-benzoxazol-2-ylsulfanyl) 1-O-tert-butyl 2-tert-butylbutanedioate Traditional Name: 2-tert-butylsuccinic acid O4-(1,3-benzoxazol-2-ylthio) ester O1-tert-butyl ester Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CC(=O)OSC1=NC2=CC=CC=C2O1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C(CC(=O)OSC1=NC2=CC=CC=C2O1)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H25NO5S/c1-18(2,3)12(16(22)24-19(4,5)6)11-15(21)25-26-17-20-13-9-7-8-10-14(13)23-17/h7-10,12H,11H2,1-6H3