methyl (2S)-2-[[(2R)-2-methyl-4-phenyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoyl]amino]propanoate

Systemtic Name: methyl (2S)-2-[[(2R)-2-methyl-4-phenyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoyl]amino]propanoate Openeye Name: methyl (2S)-2-[[(2R)-2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-2-methyl-4-phenyl-butanoyl]amino]propanoate CAS Name: (2S)-2-[[(2R)-2-methyl-1-oxo-2-[[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-phenylbutyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[(2R)-2-methyl-4-phenyl-2-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoyl]amino]propanoate Traditional Name: (2S)-2-[[(2R)-2-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-2-methyl-4-phenyl-butanoyl]amino]propionic acid methyl ester Formula: C26H33N3O6 MolecularWeight: 483.55672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(CCC1=CC=CC=C1)C(=O)NC(C)C(=O)OC)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C[C@@H](C(=O)N[C@](C)(CCC1=CC=CC=C1)C(=O)N[C@@H](C)C(=O)OC)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H33N3O6/c1-18(28-25(33)35-17-21-13-9-6-10-14-21)22(30)29-26(3,16-15-20-11-7-5-8-12-20)24(32)27-19(2)23(31)34-4/h5-14,18-19H,15-17H2,1-4H3,(H,27,32)(H,28,33)(H,29,30)/t18-,19-,26+/m0/s1