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

Systemtic Name: methyl 2-methyl-2-[[(2S)-3-phenyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoyl]amino]propanoate Openeye Name: methyl 2-[[(2S)-2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-3-phenyl-propanoyl]amino]-2-methyl-propanoate CAS Name: 2-methyl-2-[[(2S)-1-oxo-2-[[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-3-phenylpropyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[[(2S)-3-phenyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoyl]amino]propanoate Traditional Name: 2-[[(2S)-2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-3-phenyl-propanoyl]amino]-2-methyl-propionic acid methyl ester Formula: C25H31N3O6 MolecularWeight: 469.53014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C)(C)C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NC(C)(C)C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H31N3O6/c1-17(26-24(32)34-16-19-13-9-6-10-14-19)21(29)27-20(15-18-11-7-5-8-12-18)22(30)28-25(2,3)23(31)33-4/h5-14,17,20H,15-16H2,1-4H3,(H,26,32)(H,27,29)(H,28,30)/t17-,20-/m0/s1