methyl (2S,3S)-7-methoxy-3-methyl-5-oxidanyl-2-phenyl-2,3-dihydro-1-benzofuran-4-carboxylate

Systemtic Name: methyl (2S,3S)-7-methoxy-3-methyl-5-oxidanyl-2-phenyl-2,3-dihydro-1-benzofuran-4-carboxylate Openeye Name: methyl (2S,3S)-5-hydroxy-7-methoxy-3-methyl-2-phenyl-2,3-dihydrobenzofuran-4-carboxylate CAS Name: (2S,3S)-5-hydroxy-7-methoxy-3-methyl-2-phenyl-2,3-dihydrobenzofuran-4-carboxylic acid methyl ester IUPAC Name: methyl (2S,3S)-5-hydroxy-7-methoxy-3-methyl-2-phenyl-2,3-dihydro-1-benzofuran-4-carboxylate Traditional Name: (2S,3S)-5-hydroxy-7-methoxy-3-methyl-2-phenyl-coumaran-4-carboxylic acid methyl ester Formula: C18H18O5 MolecularWeight: 314.33252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(OC2=C(C=C(C(=C12)C(=O)OC)O)OC)C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1[C@H](OC2=C(C=C(C(=C12)C(=O)OC)O)OC)C3=CC=CC=C3

InChI

InChI=1S/C18H18O5/c1-10-14-15(18(20)22-3)12(19)9-13(21-2)17(14)23-16(10)11-7-5-4-6-8-11/h4-10,16,19H,1-3H3/t10-,16-/m0/s1