2,2,2-tris(chloranyl)ethyl 3-[(phenylmethyl)amino]butanoate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 3-[(phenylmethyl)amino]butanoate Openeye Name: 2,2,2-trichloroethyl 3-(benzylamino)butanoate CAS Name: 3-[(phenylmethyl)amino]butanoic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 3-(benzylamino)butanoate Traditional Name: 3-(benzylamino)butyric acid 2,2,2-trichloroethyl ester Formula: C13H16Cl3NO2 MolecularWeight: 324.63064

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)OCC(Cl)(Cl)Cl)NCC1=CC=CC=C1

Isomeric SMILES

CC(CC(=O)OCC(Cl)(Cl)Cl)NCC1=CC=CC=C1

InChI

InChI=1S/C13H16Cl3NO2/c1-10(7-12(18)19-9-13(14,15)16)17-8-11-5-3-2-4-6-11/h2-6,10,17H,7-9H2,1H3