3-[[2,5-bis(fluoranyl)phenyl]methylamino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[[2,5-bis(fluoranyl)phenyl]methylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[(2,5-difluorophenyl)methylamino]-4-fluoro-benzoic acid CAS Name: 3-[(2,5-difluorophenyl)methylamino]-4-fluorobenzoic acid IUPAC Name: 3-[(2,5-difluorophenyl)methylamino]-4-fluorobenzoic acid Traditional Name: 3-[(2,5-difluorobenzyl)amino]-4-fluoro-benzoic acid Formula: C14H10F3NO2 MolecularWeight: 281.22991

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)O)NCC2=C(C=CC(=C2)F)F)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)O)NCC2=C(C=CC(=C2)F)F)F

InChI

InChI=1S/C14H10F3NO2/c15-10-2-4-11(16)9(5-10)7-18-13-6-8(14(19)20)1-3-12(13)17/h1-6,18H,7H2,(H,19,20)