3-cyano-1-(2-phenoxyphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrrole-2-carboxamide

Systemtic Name: 3-cyano-1-(2-phenoxyphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrrole-2-carboxamide Openeye Name: 3-cyano-1-(2-phenoxyphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrrole-2-carboxamide CAS Name: 3-cyano-1-(2-phenoxyphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-2-pyrrolecarboxamide IUPAC Name: 3-cyano-1-(2-phenoxyphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrrole-2-carboxamide Traditional Name: 3-cyano-1-(2-phenoxyphenyl)-N-[3-(trifluoromethyl)benzyl]pyrrole-2-carboxamide Formula: C26H18F3N3O2 MolecularWeight: 461.43523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=CC=C2N3C=CC(=C3C(=O)NCC4=CC(=CC=C4)C(F)(F)F)C#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=CC=C2N3C=CC(=C3C(=O)NCC4=CC(=CC=C4)C(F)(F)F)C#N

InChI

InChI=1S/C26H18F3N3O2/c27-26(28,29)20-8-6-7-18(15-20)17-31-25(33)24-19(16-30)13-14-32(24)22-11-4-5-12-23(22)34-21-9-2-1-3-10-21/h1-15H,17H2,(H,31,33)