methyl (E)-7-[4-(4-fluorophenyl)-5-methyl-1-methylsulfonyl-2-propan-2-yl-pyrrol-3-yl]-3-oxidanyl-5-oxidanylidene-hept-6-enoate

Systemtic Name: methyl (E)-7-[4-(4-fluorophenyl)-5-methyl-1-methylsulfonyl-2-propan-2-yl-pyrrol-3-yl]-3-oxidanyl-5-oxidanylidene-hept-6-enoate Openeye Name: methyl (E)-7-[4-(4-fluorophenyl)-2-isopropyl-5-methyl-1-methylsulfonyl-pyrrol-3-yl]-3-hydroxy-5-oxo-hept-6-enoate CAS Name: (E)-7-[4-(4-fluorophenyl)-5-methyl-1-methylsulfonyl-2-propan-2-yl-3-pyrrolyl]-3-hydroxy-5-oxo-6-heptenoic acid methyl ester IUPAC Name: methyl (E)-7-[4-(4-fluorophenyl)-5-methyl-1-methylsulfonyl-2-propan-2-ylpyrrol-3-yl]-3-hydroxy-5-oxohept-6-enoate Traditional Name: (E)-7-[4-(4-fluorophenyl)-2-isopropyl-1-mesyl-5-methyl-pyrrol-3-yl]-3-hydroxy-5-keto-hept-6-enoic acid methyl ester Formula: C23H28FNO6S MolecularWeight: 465.534923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1S(=O)(=O)C)C(C)C)C=CC(=O)CC(CC(=O)OC)O)C2=CC=C(C=C2)F

Isomeric SMILES

CC1=C(C(=C(N1S(=O)(=O)C)C(C)C)/C=C/C(=O)CC(CC(=O)OC)O)C2=CC=C(C=C2)F

InChI

InChI=1S/C23H28FNO6S/c1-14(2)23-20(11-10-18(26)12-19(27)13-21(28)31-4)22(15(3)25(23)32(5,29)30)16-6-8-17(24)9-7-16/h6-11,14,19,27H,12-13H2,1-5H3/b11-10+