bis(phenylmethyl) (2S)-2-[[2-(4-aminophenyl)ethoxy-phenylmethoxy-phosphoryl]methyl]pentanedioate

Systemtic Name: bis(phenylmethyl) (2S)-2-[[2-(4-aminophenyl)ethoxy-phenylmethoxy-phosphoryl]methyl]pentanedioate Openeye Name: dibenzyl (2S)-2-[[2-(4-aminophenyl)ethoxy-benzyloxy-phosphoryl]methyl]pentanedioate CAS Name: (2S)-2-[[2-(4-aminophenyl)ethoxy-phenylmethoxyphosphoryl]methyl]pentanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl (2S)-2-[[2-(4-aminophenyl)ethoxy-phenylmethoxyphosphoryl]methyl]pentanedioate Traditional Name: (2S)-2-[[2-(4-aminophenyl)ethoxy-benzoxy-phosphoryl]methyl]glutaric acid dibenzyl ester Formula: C35H38NO7P MolecularWeight: 615.652481

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCC(CP(=O)(OCCC2=CC=C(C=C2)N)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CC[C@H](CP(=O)(OCCC2=CC=C(C=C2)N)OCC3=CC=CC=C3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C35H38NO7P/c36-33-19-16-28(17-20-33)22-23-42-44(39,43-26-31-14-8-3-9-15-31)27-32(35(38)41-25-30-12-6-2-7-13-30)18-21-34(37)40-24-29-10-4-1-5-11-29/h1-17,19-20,32H,18,21-27,36H2/t32-,44?/m1/s1