2,2,2-tris(chloranyl)ethyl 2-(methoxycarbonylamino)-4-phenyl-butanoate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 2-(methoxycarbonylamino)-4-phenyl-butanoate Openeye Name: 2,2,2-trichloroethyl 2-(methoxycarbonylamino)-4-phenyl-butanoate CAS Name: 2-(methoxycarbonylamino)-4-phenylbutanoic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 2-(methoxycarbonylamino)-4-phenylbutanoate Traditional Name: 2-(carbomethoxyamino)-4-phenyl-butyric acid 2,2,2-trichloroethyl ester Formula: C14H16Cl3NO4 MolecularWeight: 368.64014

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(CCC1=CC=CC=C1)C(=O)OCC(Cl)(Cl)Cl

Isomeric SMILES

COC(=O)NC(CCC1=CC=CC=C1)C(=O)OCC(Cl)(Cl)Cl

InChI

InChI=1S/C14H16Cl3NO4/c1-21-13(20)18-11(12(19)22-9-14(15,16)17)8-7-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3,(H,18,20)