5-[(4-ethoxyphenyl)methylamino]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[(4-ethoxyphenyl)methylamino]-2-fluoranyl-benzoic acid Openeye Name: 5-[(4-ethoxyphenyl)methylamino]-2-fluoro-benzoic acid CAS Name: 5-[(4-ethoxyphenyl)methylamino]-2-fluorobenzoic acid IUPAC Name: 5-[(4-ethoxyphenyl)methylamino]-2-fluorobenzoic acid Traditional Name: 5-[(4-ethoxybenzyl)amino]-2-fluoro-benzoic acid Formula: C16H16FNO3 MolecularWeight: 289.301543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CNC2=CC(=C(C=C2)F)C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)CNC2=CC(=C(C=C2)F)C(=O)O

InChI

InChI=1S/C16H16FNO3/c1-2-21-13-6-3-11(4-7-13)10-18-12-5-8-15(17)14(9-12)16(19)20/h3-9,18H,2,10H2,1H3,(H,19,20)