3-[1-(3-bromophenyl)propylamino]-4-fluoranyl-benzoic acid

Systemtic Name: 3-[1-(3-bromophenyl)propylamino]-4-fluoranyl-benzoic acid Openeye Name: 3-[1-(3-bromophenyl)propylamino]-4-fluoro-benzoic acid CAS Name: 3-[1-(3-bromophenyl)propylamino]-4-fluorobenzoic acid IUPAC Name: 3-[1-(3-bromophenyl)propylamino]-4-fluorobenzoic acid Traditional Name: 3-[1-(3-bromophenyl)propylamino]-4-fluoro-benzoic acid Formula: C16H15BrFNO2 MolecularWeight: 352.198203

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)Br)NC2=C(C=CC(=C2)C(=O)O)F

Isomeric SMILES

CCC(C1=CC(=CC=C1)Br)NC2=C(C=CC(=C2)C(=O)O)F

InChI

InChI=1S/C16H15BrFNO2/c1-2-14(10-4-3-5-12(17)8-10)19-15-9-11(16(20)21)6-7-13(15)18/h3-9,14,19H,2H2,1H3,(H,20,21)