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

Systemtic Name: 4-fluoranyl-3-(4-phenylbutan-2-ylamino)benzoic acid Openeye Name: 4-fluoro-3-[(1-methyl-3-phenyl-propyl)amino]benzoic acid CAS Name: 4-fluoro-3-(4-phenylbutan-2-ylamino)benzoic acid IUPAC Name: 4-fluoro-3-(4-phenylbutan-2-ylamino)benzoic acid Traditional Name: 4-fluoro-3-[(1-methyl-3-phenyl-propyl)amino]benzoic acid Formula: C17H18FNO2 MolecularWeight: 287.328723

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC2=C(C=CC(=C2)C(=O)O)F

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC2=C(C=CC(=C2)C(=O)O)F

InChI

InChI=1S/C17H18FNO2/c1-12(7-8-13-5-3-2-4-6-13)19-16-11-14(17(20)21)9-10-15(16)18/h2-6,9-12,19H,7-8H2,1H3,(H,20,21)