4-fluoranyl-3-(heptan-2-ylamino)benzoic acid

Systemtic Name: 4-fluoranyl-3-(heptan-2-ylamino)benzoic acid Openeye Name: 4-fluoro-3-(1-methylhexylamino)benzoic acid CAS Name: 4-fluoro-3-(heptan-2-ylamino)benzoic acid IUPAC Name: 4-fluoro-3-(heptan-2-ylamino)benzoic acid Traditional Name: 4-fluoro-3-(1-methylhexylamino)benzoic acid Formula: C14H20FNO2 MolecularWeight: 253.312503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20FNO2/c1-3-4-5-6-10(2)16-13-9-11(14(17)18)7-8-12(13)15/h7-10,16H,3-6H2,1-2H3,(H,17,18)