2-[ethyl(2-methylpropyl)amino]-5-fluoranyl-benzoic acid

Systemtic Name: 2-[ethyl(2-methylpropyl)amino]-5-fluoranyl-benzoic acid Openeye Name: 2-[ethyl(isobutyl)amino]-5-fluoro-benzoic acid CAS Name: 2-[ethyl(2-methylpropyl)amino]-5-fluorobenzoic acid IUPAC Name: 2-[ethyl(2-methylpropyl)amino]-5-fluorobenzoic acid Traditional Name: 2-[ethyl(isobutyl)amino]-5-fluoro-benzoic acid Formula: C13H18FNO2 MolecularWeight: 239.285923

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(C)C)C1=C(C=C(C=C1)F)C(=O)O

Isomeric SMILES

CCN(CC(C)C)C1=C(C=C(C=C1)F)C(=O)O

InChI

InChI=1S/C13H18FNO2/c1-4-15(8-9(2)3)12-6-5-10(14)7-11(12)13(16)17/h5-7,9H,4,8H2,1-3H3,(H,16,17)