methyl (4S)-5-cyano-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate

Systemtic Name: methyl (4S)-5-cyano-4-(3,5-dimethoxy-4-oxidanyl-phenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate Openeye Name: methyl (4S)-5-cyano-4-(4-hydroxy-3,5-dimethoxy-phenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate CAS Name: (4S)-5-cyano-4-(4-hydroxy-3,5-dimethoxyphenyl)-2-methyl-6-(1-pyrrolyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-5-cyano-4-(4-hydroxy-3,5-dimethoxyphenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate Traditional Name: (4S)-5-cyano-4-(4-hydroxy-3,5-dimethoxy-phenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylic acid methyl ester Formula: C21H20N2O6 MolecularWeight: 396.3933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(O1)N2C=CC=C2)C#N)C3=CC(=C(C(=C3)OC)O)OC)C(=O)OC

Isomeric SMILES

CC1=C([C@H](C(=C(O1)N2C=CC=C2)C#N)C3=CC(=C(C(=C3)OC)O)OC)C(=O)OC

InChI

InChI=1S/C21H20N2O6/c1-12-17(21(25)28-4)18(13-9-15(26-2)19(24)16(10-13)27-3)14(11-22)20(29-12)23-7-5-6-8-23/h5-10,18,24H,1-4H3/t18-/m0/s1