methyl (4S)-5-cyano-4-[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate

Systemtic Name: methyl (4S)-5-cyano-4-[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate Openeye Name: methyl (4S)-5-cyano-4-[4-[(4-fluorophenyl)methoxy]-3-methoxy-phenyl]-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate CAS Name: (4S)-5-cyano-4-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]-2-methyl-6-(1-pyrrolyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-5-cyano-4-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylate Traditional Name: (4S)-5-cyano-4-[4-(4-fluorobenzyl)oxy-3-methoxy-phenyl]-2-methyl-6-pyrrol-1-yl-4H-pyran-3-carboxylic acid methyl ester Formula: C27H23FN2O5 MolecularWeight: 474.480323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(O1)N2C=CC=C2)C#N)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)F)OC)C(=O)OC

Isomeric SMILES

CC1=C([C@H](C(=C(O1)N2C=CC=C2)C#N)C3=CC(=C(C=C3)OCC4=CC=C(C=C4)F)OC)C(=O)OC

InChI

InChI=1S/C27H23FN2O5/c1-17-24(27(31)33-3)25(21(15-29)26(35-17)30-12-4-5-13-30)19-8-11-22(23(14-19)32-2)34-16-18-6-9-20(28)10-7-18/h4-14,25H,16H2,1-3H3/t25-/m0/s1