2-fluoranyl-5-(5-methylheptan-3-ylamino)benzoic acid

Systemtic Name: 2-fluoranyl-5-(5-methylheptan-3-ylamino)benzoic acid Openeye Name: 5-[(1-ethyl-3-methyl-pentyl)amino]-2-fluoro-benzoic acid CAS Name: 2-fluoro-5-(5-methylheptan-3-ylamino)benzoic acid IUPAC Name: 2-fluoro-5-(5-methylheptan-3-ylamino)benzoic acid Traditional Name: 5-[(1-ethyl-3-methyl-pentyl)amino]-2-fluoro-benzoic acid Formula: C15H22FNO2 MolecularWeight: 267.339083

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)NC1=CC(=C(C=C1)F)C(=O)O

Isomeric SMILES

CCC(C)CC(CC)NC1=CC(=C(C=C1)F)C(=O)O

InChI

InChI=1S/C15H22FNO2/c1-4-10(3)8-11(5-2)17-12-6-7-14(16)13(9-12)15(18)19/h6-7,9-11,17H,4-5,8H2,1-3H3,(H,18,19)