methyl (3aS,4S,6R,7R,7aR)-6-methyl-3-methylidene-3a-oxidanyl-7-phenylmethoxy-5,6,7,7a-tetrahydro-4H-1-benzofuran-4-carboxylate

Systemtic Name: methyl (3aS,4S,6R,7R,7aR)-6-methyl-3-methylidene-3a-oxidanyl-7-phenylmethoxy-5,6,7,7a-tetrahydro-4H-1-benzofuran-4-carboxylate Openeye Name: methyl (3aS,4S,6R,7R,7aR)-7-benzyloxy-3a-hydroxy-6-methyl-3-methylene-5,6,7,7a-tetrahydro-4H-benzofuran-4-carboxylate CAS Name: (3aS,4S,6R,7R,7aR)-3a-hydroxy-6-methyl-3-methylene-7-phenylmethoxy-5,6,7,7a-tetrahydro-4H-benzofuran-4-carboxylic acid methyl ester IUPAC Name: methyl (3aS,4S,6R,7R,7aR)-3a-hydroxy-6-methyl-3-methylidene-7-phenylmethoxy-5,6,7,7a-tetrahydro-4H-1-benzofuran-4-carboxylate Traditional Name: (3aS,4S,6R,7R,7aR)-7-benzoxy-3a-hydroxy-6-methyl-3-methylene-5,6,7,7a-tetrahydro-4H-benzofuran-4-carboxylic acid methyl ester Formula: C19H24O5 MolecularWeight: 332.39086

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C2(C(C1OCC3=CC=CC=C3)OCC2=C)O)C(=O)OC

Isomeric SMILES

C[C@@H]1C[C@@H]([C@]2([C@@H]([C@@H]1OCC3=CC=CC=C3)OCC2=C)O)C(=O)OC

InChI

InChI=1S/C19H24O5/c1-12-9-15(18(20)22-3)19(21)13(2)10-24-17(19)16(12)23-11-14-7-5-4-6-8-14/h4-8,12,15-17,21H,2,9-11H2,1,3H3/t12-,15-,16-,17-,19-/m1/s1