(phenylmethyl) (2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]-methyl-amino]-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) (2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]-methyl-amino]-3-phenyl-propanoate Openeye Name: benzyl (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]-methyl-amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]-methylamino]-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]-methylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]-methyl-amino]-3-phenyl-propionic acid benzyl ester Formula: C26H28N2O3 MolecularWeight: 416.51212

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CN([C@@H](CC1=CC=CC=C1)C(=O)OCC2=CC=CC=C2)C(=O)[C@H](CC3=CC=CC=C3)N

InChI

InChI=1S/C26H28N2O3/c1-28(25(29)23(27)17-20-11-5-2-6-12-20)24(18-21-13-7-3-8-14-21)26(30)31-19-22-15-9-4-10-16-22/h2-16,23-24H,17-19,27H2,1H3/t23-,24-/m0/s1