2-azanylethanoic acid; 3,5-bis(trifluoromethyl)benzaldehyde

Systemtic Name: 2-azanylethanoic acid; 3,5-bis(trifluoromethyl)benzaldehyde Openeye Name: 2-aminoacetic acid; 3,5-bis(trifluoromethyl)benzaldehyde CAS Name: 2-aminoacetic acid; 3,5-bis(trifluoromethyl)benzaldehyde IUPAC Name: 2-aminoacetic acid; 3,5-bis(trifluoromethyl)benzaldehyde Traditional Name: 2-aminoacetic acid; 3,5-bis(trifluoromethyl)benzaldehyde Formula: C11H9F6NO3 MolecularWeight: 317.184479

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=O.C(C(=O)O)N

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=O.C(C(=O)O)N

InChI

InChI=1S/C9H4F6O.C2H5NO2/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15;3-1-2(4)5/h1-4H;1,3H2,(H,4,5)