3-[5-(4-carbamimidoylphenyl)pentanoylamino]-2-fluoranyl-propanoic acid

Systemtic Name: 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-2-fluoranyl-propanoic acid Openeye Name: 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-2-fluoro-propanoic acid CAS Name: 3-[[5-(4-carbamimidoylphenyl)-1-oxopentyl]amino]-2-fluoropropanoic acid IUPAC Name: 3-[5-(4-carbamimidoylphenyl)pentanoylamino]-2-fluoropropanoic acid Traditional Name: 3-[5-(4-amidinophenyl)pentanoylamino]-2-fluoro-propionic acid Formula: C15H20FN3O3 MolecularWeight: 309.336003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCC(=O)NCC(C(=O)O)F)C(=N)N

Isomeric SMILES

C1=CC(=CC=C1CCCCC(=O)NCC(C(=O)O)F)C(=N)N

InChI

InChI=1S/C15H20FN3O3/c16-12(15(21)22)9-19-13(20)4-2-1-3-10-5-7-11(8-6-10)14(17)18/h5-8,12H,1-4,9H2,(H3,17,18)(H,19,20)(H,21,22)