bis(phenylmethyl) (2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]pentanedioate

Systemtic Name: bis(phenylmethyl) (2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]pentanedioate Openeye Name: dibenzyl (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]pentanedioate CAS Name: (2S)-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]amino]pentanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]pentanedioate Traditional Name: (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]glutaric acid dibenzyl ester Formula: C28H30N2O5 MolecularWeight: 474.5482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CCC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)N

Isomeric SMILES

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

InChI

InChI=1S/C28H30N2O5/c29-24(18-21-10-4-1-5-11-21)27(32)30-25(28(33)35-20-23-14-8-3-9-15-23)16-17-26(31)34-19-22-12-6-2-7-13-22/h1-15,24-25H,16-20,29H2,(H,30,32)/t24-,25-/m0/s1