3-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[(5-chloranyl-2-oxidanyl-phenyl)methylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[(5-chloro-2-hydroxy-phenyl)methylamino]-4-fluoro-benzoic acid CAS Name: 3-[(5-chloro-2-hydroxyphenyl)methylamino]-4-fluorobenzoic acid IUPAC Name: 3-[(5-chloro-2-hydroxyphenyl)methylamino]-4-fluorobenzoic acid Traditional Name: 3-[(5-chloro-2-hydroxy-benzyl)amino]-4-fluoro-benzoic acid Formula: C14H11ClFNO3 MolecularWeight: 295.693443

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11ClFNO3/c15-10-2-4-13(18)9(5-10)7-17-12-6-8(14(19)20)1-3-11(12)16/h1-6,17-18H,7H2,(H,19,20)