ethyl 4-[(2R)-3-(tert-butylamino)-2-oxidanyl-propoxy]-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 4-[(2R)-3-(tert-butylamino)-2-oxidanyl-propoxy]-3-methyl-1-benzofuran-2-carboxylate Openeye Name: ethyl 4-[(2R)-3-(tert-butylamino)-2-hydroxy-propoxy]-3-methyl-benzofuran-2-carboxylate CAS Name: 4-[(2R)-3-(tert-butylamino)-2-hydroxypropoxy]-3-methyl-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2R)-3-(tert-butylamino)-2-hydroxypropoxy]-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 4-[(2R)-3-(tert-butylamino)-2-hydroxy-propoxy]-3-methyl-coumarilic acid ethyl ester Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OCC(CNC(C)(C)C)O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC=C2OC[C@@H](CNC(C)(C)C)O)C

InChI

InChI=1S/C19H27NO5/c1-6-23-18(22)17-12(2)16-14(8-7-9-15(16)25-17)24-11-13(21)10-20-19(3,4)5/h7-9,13,20-21H,6,10-11H2,1-5H3/t13-/m1/s1