4-[[2-(5-fluoranyl-2-methoxy-phenyl)ethylamino]methyl]benzoic acid

Systemtic Name: 4-[[2-(5-fluoranyl-2-methoxy-phenyl)ethylamino]methyl]benzoic acid Openeye Name: 4-[[2-(5-fluoro-2-methoxy-phenyl)ethylamino]methyl]benzoic acid CAS Name: 4-[[2-(5-fluoro-2-methoxyphenyl)ethylamino]methyl]benzoic acid IUPAC Name: 4-[[2-(5-fluoro-2-methoxyphenyl)ethylamino]methyl]benzoic acid Traditional Name: 4-[[2-(5-fluoro-2-methoxy-phenyl)ethylamino]methyl]benzoic acid Formula: C17H18FNO3 MolecularWeight: 303.328123

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)CCNCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)F)CCNCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C17H18FNO3/c1-22-16-7-6-15(18)10-14(16)8-9-19-11-12-2-4-13(5-3-12)17(20)21/h2-7,10,19H,8-9,11H2,1H3,(H,20,21)