methyl (2R,3S)-2-(3,4-dimethoxyphenyl)-7-methoxy-5-(3-methoxy-3-oxidanylidene-propyl)-2,3-dihydro-1-benzofuran-3-carboxylate

Systemtic Name: methyl (2R,3S)-2-(3,4-dimethoxyphenyl)-7-methoxy-5-(3-methoxy-3-oxidanylidene-propyl)-2,3-dihydro-1-benzofuran-3-carboxylate Openeye Name: methyl (2R,3S)-2-(3,4-dimethoxyphenyl)-7-methoxy-5-(3-methoxy-3-oxo-propyl)-2,3-dihydrobenzofuran-3-carboxylate CAS Name: (2R,3S)-2-(3,4-dimethoxyphenyl)-7-methoxy-5-(3-methoxy-3-oxopropyl)-2,3-dihydrobenzofuran-3-carboxylic acid methyl ester IUPAC Name: methyl (2R,3S)-2-(3,4-dimethoxyphenyl)-7-methoxy-5-(3-methoxy-3-oxopropyl)-2,3-dihydro-1-benzofuran-3-carboxylate Traditional Name: (2R,3S)-2-(3,4-dimethoxyphenyl)-5-(3-keto-3-methoxy-propyl)-7-methoxy-coumaran-3-carboxylic acid methyl ester Formula: C23H26O8 MolecularWeight: 430.44774

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C(C3=CC(=CC(=C3O2)OC)CCC(=O)OC)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2[C@H](C3=CC(=CC(=C3O2)OC)CCC(=O)OC)C(=O)OC)OC

InChI

InChI=1S/C23H26O8/c1-26-16-8-7-14(12-17(16)27-2)21-20(23(25)30-5)15-10-13(6-9-19(24)29-4)11-18(28-3)22(15)31-21/h7-8,10-12,20-21H,6,9H2,1-5H3/t20-,21-/m0/s1