3-azanyl-6-[2-[2-[[2,4-bis(fluoranyl)phenyl]methoxy]-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrazine-2-carboxylic acid

Systemtic Name: 3-azanyl-6-[2-[2-[[2,4-bis(fluoranyl)phenyl]methoxy]-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrazine-2-carboxylic acid Openeye Name: 3-amino-6-[2-[2-[(2,4-difluorophenyl)methoxy]-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrazine-2-carboxylic acid CAS Name: 3-amino-6-[2-[2-[(2,4-difluorophenyl)methoxy]-5-(trifluoromethyl)phenyl]-1-cyclopentenyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-amino-6-[2-[2-[(2,4-difluorophenyl)methoxy]-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrazine-2-carboxylic acid Traditional Name: 3-amino-6-[2-[2-(2,4-difluorobenzyl)oxy-5-(trifluoromethyl)phenyl]cyclopenten-1-yl]pyrazinoic acid Formula: C24H18F5N3O3 MolecularWeight: 491.410036

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=C(C1)C2=CN=C(C(=N2)C(=O)O)N)C3=C(C=CC(=C3)C(F)(F)F)OCC4=C(C=C(C=C4)F)F

Isomeric SMILES

C1CC(=C(C1)C2=CN=C(C(=N2)C(=O)O)N)C3=C(C=CC(=C3)C(F)(F)F)OCC4=C(C=C(C=C4)F)F

InChI

InChI=1S/C24H18F5N3O3/c25-14-6-4-12(18(26)9-14)11-35-20-7-5-13(24(27,28)29)8-17(20)15-2-1-3-16(15)19-10-31-22(30)21(32-19)23(33)34/h4-10H,1-3,11H2,(H2,30,31)(H,33,34)