2,2,2-tris(chloranyl)ethyl 3-[(phenylmethyl)-prop-2-ynyl-amino]propanoate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 3-[(phenylmethyl)-prop-2-ynyl-amino]propanoate Openeye Name: 2,2,2-trichloroethyl 3-[benzyl(prop-2-ynyl)amino]propanoate CAS Name: 3-[(phenylmethyl)-prop-2-ynylamino]propanoic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 3-[benzyl(prop-2-ynyl)amino]propanoate Traditional Name: 3-[benzyl(propargyl)amino]propionic acid 2,2,2-trichloroethyl ester Formula: C15H16Cl3NO2 MolecularWeight: 348.65204

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(CCC(=O)OCC(Cl)(Cl)Cl)CC1=CC=CC=C1

Isomeric SMILES

C#CCN(CCC(=O)OCC(Cl)(Cl)Cl)CC1=CC=CC=C1

InChI

InChI=1S/C15H16Cl3NO2/c1-2-9-19(11-13-6-4-3-5-7-13)10-8-14(20)21-12-15(16,17)18/h1,3-7H,8-12H2