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

Systemtic Name: methyl (4S)-5-cyano-4-(2,3-dimethoxyphenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate Openeye Name: methyl (4S)-5-cyano-4-(2,3-dimethoxyphenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate CAS Name: (4S)-5-cyano-4-(2,3-dimethoxyphenyl)-2-methyl-6-(1-pyrrolyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-5-cyano-4-(2,3-dimethoxyphenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate Traditional Name: (4S)-5-cyano-4-(2,3-dimethoxyphenyl)-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N2O5/c1-13-17(21(24)27-4)18(14-8-7-9-16(25-2)19(14)26-3)15(12-22)20(28-13)23-10-5-6-11-23/h5-11,18H,1-4H3/t18-/m0/s1