2-(3-azanylpropoxy)benzenecarboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-(3-azanylpropoxy)benzenecarboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-(3-aminopropoxy)benzamidine; 2,2,2-trifluoroacetic acid CAS Name: 2-(3-aminopropoxy)benzenecarboximidamide; 2,2,2-trifluoroacetic acid IUPAC Name: 2-(3-aminopropoxy)benzenecarboximidamide; 2,2,2-trifluoroacetic acid Traditional Name: 2-(3-aminopropoxy)benzamidine; 2,2,2-trifluoroacetic acid Formula: C14H17F6N3O5 MolecularWeight: 421.292299

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=N)N)OCCCN.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=N)N)OCCCN.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C10H15N3O.2C2HF3O2/c11-6-3-7-14-9-5-2-1-4-8(9)10(12)13;2*3-2(4,5)1(6)7/h1-2,4-5H,3,6-7,11H2,(H3,12,13);2*(H,6,7)