ethyl (2R,3R)-9-methoxy-3-oxidanyl-2,3,4,5-tetrahydro-1-benzoxepine-2-carboxylate

Systemtic Name: ethyl (2R,3R)-9-methoxy-3-oxidanyl-2,3,4,5-tetrahydro-1-benzoxepine-2-carboxylate Openeye Name: ethyl (2R,3R)-3-hydroxy-9-methoxy-2,3,4,5-tetrahydro-1-benzoxepine-2-carboxylate CAS Name: (2R,3R)-3-hydroxy-9-methoxy-2,3,4,5-tetrahydro-1-benzoxepin-2-carboxylic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-hydroxy-9-methoxy-2,3,4,5-tetrahydro-1-benzoxepine-2-carboxylate Traditional Name: (2R,3R)-3-hydroxy-9-methoxy-2,3,4,5-tetrahydro-1-benzoxepin-2-carboxylic acid ethyl ester Formula: C14H18O5 MolecularWeight: 266.28972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CCC2=C(O1)C(=CC=C2)OC)O

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](CCC2=C(O1)C(=CC=C2)OC)O

InChI

InChI=1S/C14H18O5/c1-3-18-14(16)13-10(15)8-7-9-5-4-6-11(17-2)12(9)19-13/h4-6,10,13,15H,3,7-8H2,1-2H3/t10-,13-/m1/s1