methyl 4-[[2-(2-chloranyl-4-cyano-phenoxy)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(2-chloranyl-4-cyano-phenoxy)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-(2-chloro-4-cyano-phenoxy)acetyl]amino]methyl]benzoate CAS Name: 4-[[[2-(2-chloro-4-cyanophenoxy)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-(2-chloro-4-cyanophenoxy)acetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(2-chloro-4-cyano-phenoxy)acetyl]amino]methyl]benzoic acid methyl ester Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)COC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)COC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C18H15ClN2O4/c1-24-18(23)14-5-2-12(3-6-14)10-21-17(22)11-25-16-7-4-13(9-20)8-15(16)19/h2-8H,10-11H2,1H3,(H,21,22)