2-azanyl-6-[bis(azanyl)methylideneamino]-2-(fluoranylmethyl)octanoic acid

Systemtic Name: 2-azanyl-6-[bis(azanyl)methylideneamino]-2-(fluoranylmethyl)octanoic acid Openeye Name: 2-amino-2-(fluoromethyl)-6-guanidino-octanoic acid CAS Name: 2-amino-6-(diaminomethylideneamino)-2-(fluoromethyl)octanoic acid IUPAC Name: 2-amino-6-(diaminomethylideneamino)-2-(fluoromethyl)octanoic acid Traditional Name: 2-amino-2-(fluoromethyl)-6-guanidino-caprylic acid Formula: C10H21FN4O2 MolecularWeight: 248.297743

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCC(CF)(C(=O)O)N)N=C(N)N

Isomeric SMILES

CCC(CCCC(CF)(C(=O)O)N)N=C(N)N

InChI

InChI=1S/C10H21FN4O2/c1-2-7(15-9(12)13)4-3-5-10(14,6-11)8(16)17/h7H,2-6,14H2,1H3,(H,16,17)(H4,12,13,15)