4-[[3-[(3-fluorophenyl)amino]-3-oxidanylidene-propyl]amino]butanoic acid

Systemtic Name: 4-[[3-[(3-fluorophenyl)amino]-3-oxidanylidene-propyl]amino]butanoic acid Openeye Name: 4-[[3-(3-fluoroanilino)-3-oxo-propyl]amino]butanoic acid CAS Name: 4-[[3-(3-fluoroanilino)-3-oxopropyl]amino]butanoic acid IUPAC Name: 4-[[3-(3-fluoroanilino)-3-oxopropyl]amino]butanoic acid Traditional Name: 4-[[3-(3-fluoroanilino)-3-keto-propyl]amino]butyric acid Formula: C13H17FN2O3 MolecularWeight: 268.284083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)NC(=O)CCNCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)F)NC(=O)CCNCCCC(=O)O

InChI

InChI=1S/C13H17FN2O3/c14-10-3-1-4-11(9-10)16-12(17)6-8-15-7-2-5-13(18)19/h1,3-4,9,15H,2,5-8H2,(H,16,17)(H,18,19)