dimethyl (4R,4aS)-4-methoxy-3,4,4a,7-tetrahydro-2H-chromene-5,6-dicarboxylate

Systemtic Name: dimethyl (4R,4aS)-4-methoxy-3,4,4a,7-tetrahydro-2H-chromene-5,6-dicarboxylate Openeye Name: dimethyl (4R,4aS)-4-methoxy-3,4,4a,7-tetrahydro-2H-chromene-5,6-dicarboxylate CAS Name: (4R,4aS)-4-methoxy-3,4,4a,7-tetrahydro-2H-1-benzopyran-5,6-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4R,4aS)-4-methoxy-3,4,4a,7-tetrahydro-2H-chromene-5,6-dicarboxylate Traditional Name: (4R,4aS)-4-methoxy-3,4,4a,7-tetrahydro-2H-chromene-5,6-dicarboxylic acid dimethyl ester Formula: C14H18O6 MolecularWeight: 282.28912

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCOC2=CCC(=C(C12)C(=O)OC)C(=O)OC

Isomeric SMILES

CO[C@@H]1CCOC2=CCC(=C([C@@H]12)C(=O)OC)C(=O)OC

InChI

InChI=1S/C14H18O6/c1-17-9-6-7-20-10-5-4-8(13(15)18-2)11(12(9)10)14(16)19-3/h5,9,12H,4,6-7H2,1-3H3/t9-,12+/m1/s1