2-azanyl-6-[(4-fluorophenyl)methylamino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 2-azanyl-6-[(4-fluorophenyl)methylamino]-6-oxidanylidene-hexanoic acid Openeye Name: 2-amino-6-[(4-fluorophenyl)methylamino]-6-oxo-hexanoic acid CAS Name: 2-amino-6-[(4-fluorophenyl)methylamino]-6-oxohexanoic acid IUPAC Name: 2-amino-6-[(4-fluorophenyl)methylamino]-6-oxohexanoic acid Traditional Name: 2-amino-6-[(4-fluorobenzyl)amino]-6-keto-hexanoic acid Formula: C13H17FN2O3 MolecularWeight: 268.284083

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)CCCC(C(=O)O)N)F

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)CCCC(C(=O)O)N)F

InChI

InChI=1S/C13H17FN2O3/c14-10-6-4-9(5-7-10)8-16-12(17)3-1-2-11(15)13(18)19/h4-7,11H,1-3,8,15H2,(H,16,17)(H,18,19)