2-azanyl-3-phenylmethoxy-propanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-azanyl-3-phenylmethoxy-propanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-amino-3-benzyloxy-propanamide; 2,2,2-trifluoroacetic acid CAS Name: 2-amino-3-phenylmethoxypropanamide; 2,2,2-trifluoroacetic acid IUPAC Name: 2-amino-3-phenylmethoxypropanamide; 2,2,2-trifluoroacetic acid Traditional Name: 2-amino-3-benzoxy-propionamide; 2,2,2-trifluoroacetic acid Formula: C14H16F6N2O6 MolecularWeight: 422.277059

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14N2O2.2C2HF3O2/c11-9(10(12)13)7-14-6-8-4-2-1-3-5-8;2*3-2(4,5)1(6)7/h1-5,9H,6-7,11H2,(H2,12,13);2*(H,6,7)