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

Systemtic Name: 3-(3-azanylpropoxy)benzenecarboximidamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 3-(3-aminopropoxy)benzamidine; 2,2,2-trifluoroacetic acid CAS Name: 3-(3-aminopropoxy)benzenecarboximidamide; 2,2,2-trifluoroacetic acid IUPAC Name: 3-(3-aminopropoxy)benzenecarboximidamide; 2,2,2-trifluoroacetic acid Traditional Name: 3-(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(=CC(=C1)OCCCN)C(=N)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

Isomeric SMILES

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

InChI

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