methyl 2-[(4-chlorophenyl)amino]-2-(ethoxycarbonylamino)-3,3,3-tris(fluoranyl)propanoate

Systemtic Name: methyl 2-[(4-chlorophenyl)amino]-2-(ethoxycarbonylamino)-3,3,3-tris(fluoranyl)propanoate Openeye Name: methyl 2-(4-chloroanilino)-2-(ethoxycarbonylamino)-3,3,3-trifluoro-propanoate CAS Name: 2-(4-chloroanilino)-2-(ethoxycarbonylamino)-3,3,3-trifluoropropanoic acid methyl ester IUPAC Name: methyl 2-(4-chloroanilino)-2-(ethoxycarbonylamino)-3,3,3-trifluoropropanoate Traditional Name: 2-(carbethoxyamino)-2-(4-chloroanilino)-3,3,3-trifluoro-propionic acid methyl ester Formula: C13H14ClF3N2O4 MolecularWeight: 354.70947

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(C(=O)OC)(C(F)(F)F)NC1=CC=C(C=C1)Cl

Isomeric SMILES

CCOC(=O)NC(C(=O)OC)(C(F)(F)F)NC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H14ClF3N2O4/c1-3-23-11(21)19-12(10(20)22-2,13(15,16)17)18-9-6-4-8(14)5-7-9/h4-7,18H,3H2,1-2H3,(H,19,21)