2-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]ethyl 4-fluoranylbenzoate

Systemtic Name: 2-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]ethyl 4-fluoranylbenzoate Openeye Name: 2-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]ethyl 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid 2-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)-3-pyrrolyl]ethyl ester IUPAC Name: 2-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]ethyl 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid 2-[1-(4-fluorophenyl)-5-(4-mesylphenyl)-2-methyl-pyrrol-3-yl]ethyl ester Formula: C27H23F2NO4S MolecularWeight: 495.537626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)CCOC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C=C(N1C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)CCOC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H23F2NO4S/c1-18-21(15-16-34-27(31)20-3-7-22(28)8-4-20)17-26(30(18)24-11-9-23(29)10-12-24)19-5-13-25(14-6-19)35(2,32)33/h3-14,17H,15-16H2,1-2H3