[(Z)-[2,2,2-tris(fluoranyl)-1-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]ethylidene]amino] 4-fluoranylbenzoate

Systemtic Name: [(Z)-[2,2,2-tris(fluoranyl)-1-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]ethylidene]amino] 4-fluoranylbenzoate Openeye Name: [(Z)-[2,2,2-trifluoro-1-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]ethylidene]amino] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [(Z)-[2,2,2-trifluoro-1-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)-3-pyrrolyl]ethylidene]amino] ester IUPAC Name: [(Z)-[2,2,2-trifluoro-1-[1-(4-fluorophenyl)-2-methyl-5-(4-methylsulfonylphenyl)pyrrol-3-yl]ethylidene]amino] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [(Z)-[2,2,2-trifluoro-1-[1-(4-fluorophenyl)-5-(4-mesylphenyl)-2-methyl-pyrrol-3-yl]ethylidene]amino] ester Formula: C27H19F5N2O4S MolecularWeight: 562.507776

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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)C(=NOC(=O)C4=CC=C(C=C4)F)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(N1C2=CC=C(C=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)/C(=N/OC(=O)C4=CC=C(C=C4)F)/C(F)(F)F

InChI

InChI=1S/C27H19F5N2O4S/c1-16-23(25(27(30,31)32)33-38-26(35)18-3-7-19(28)8-4-18)15-24(34(16)21-11-9-20(29)10-12-21)17-5-13-22(14-6-17)39(2,36)37/h3-15H,1-2H3/b33-25-