5-azanyl-2-(2-azanylpropanoylamino)-2-[bis(fluoranyl)methyl]pentanoic acid

Systemtic Name: 5-azanyl-2-(2-azanylpropanoylamino)-2-[bis(fluoranyl)methyl]pentanoic acid Openeye Name: 5-amino-2-(2-aminopropanoylamino)-2-(difluoromethyl)pentanoic acid CAS Name: 5-amino-2-[(2-amino-1-oxopropyl)amino]-2-(difluoromethyl)pentanoic acid IUPAC Name: 5-amino-2-(2-aminopropanoylamino)-2-(difluoromethyl)pentanoic acid Traditional Name: 2-(alanylamino)-5-amino-2-(difluoromethyl)valeric acid Formula: C9H17F2N3O3 MolecularWeight: 253.246386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CCCN)(C(F)F)C(=O)O)N

Isomeric SMILES

CC(C(=O)NC(CCCN)(C(F)F)C(=O)O)N

InChI

InChI=1S/C9H17F2N3O3/c1-5(13)6(15)14-9(7(10)11,8(16)17)3-2-4-12/h5,7H,2-4,12-13H2,1H3,(H,14,15)(H,16,17)