bis(phenylmethyl) (2R)-2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]pentanedioate

Systemtic Name: bis(phenylmethyl) (2R)-2-[2-(4-chloranyl-2-methyl-phenoxy)ethanoylamino]pentanedioate Openeye Name: dibenzyl (2R)-2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]pentanedioate CAS Name: (2R)-2-[[2-(4-chloro-2-methylphenoxy)-1-oxoethyl]amino]pentanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl (2R)-2-[[2-(4-chloro-2-methylphenoxy)acetyl]amino]pentanedioate Traditional Name: (2R)-2-[[2-(4-chloro-2-methyl-phenoxy)acetyl]amino]glutaric acid dibenzyl ester Formula: C28H28ClNO6 MolecularWeight: 509.97802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)NC(CCC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)N[C@H](CCC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H28ClNO6/c1-20-16-23(29)12-14-25(20)34-19-26(31)30-24(28(33)36-18-22-10-6-3-7-11-22)13-15-27(32)35-17-21-8-4-2-5-9-21/h2-12,14,16,24H,13,15,17-19H2,1H3,(H,30,31)/t24-/m1/s1