[2-[[(2R)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(2-chloranyl-4-phenyl-phenoxy)ethanoate

Systemtic Name: [2-[[(2R)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethyl] 2-(2-chloranyl-4-phenyl-phenoxy)ethanoate Openeye Name: [2-[[(1R)-1-cyano-1,2-dimethyl-propyl]amino]-2-oxo-ethyl] 2-(2-chloro-4-phenyl-phenoxy)acetate CAS Name: 2-(2-chloro-4-phenylphenoxy)acetic acid [2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethyl] 2-(2-chloro-4-phenylphenoxy)acetate Traditional Name: 2-(2-chloro-4-phenyl-phenoxy)acetic acid [2-[[(1R)-1-cyano-1,2-dimethyl-propyl]amino]-2-keto-ethyl] ester Formula: C22H23ClN2O4 MolecularWeight: 414.88202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)COC(=O)COC1=C(C=C(C=C1)C2=CC=CC=C2)Cl

Isomeric SMILES

CC(C)[C@](C)(C#N)NC(=O)COC(=O)COC1=C(C=C(C=C1)C2=CC=CC=C2)Cl

InChI

InChI=1S/C22H23ClN2O4/c1-15(2)22(3,14-24)25-20(26)12-29-21(27)13-28-19-10-9-17(11-18(19)23)16-7-5-4-6-8-16/h4-11,15H,12-13H2,1-3H3,(H,25,26)/t22-/m0/s1