(2S)-3-methyl-2-[[(2S)-3-phenyl-2-(phenylcarbonyloxycarbonylamino)propanoyl]amino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[[(2S)-3-phenyl-2-(phenylcarbonyloxycarbonylamino)propanoyl]amino]butanoic acid Openeye Name: (2S)-2-[[(2S)-2-(benzoyloxycarbonylamino)-3-phenyl-propanoyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[(2S)-2-[[benzoyloxy(oxo)methyl]amino]-1-oxo-3-phenylpropyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[(2S)-2-(benzoyloxycarbonylamino)-3-phenylpropanoyl]amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[(2S)-2-(benzoyloxycarbonylamino)-3-phenyl-propanoyl]amino]-3-methyl-butyric acid Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N2O6/c1-14(2)18(20(26)27)24-19(25)17(13-15-9-5-3-6-10-15)23-22(29)30-21(28)16-11-7-4-8-12-16/h3-12,14,17-18H,13H2,1-2H3,(H,23,29)(H,24,25)(H,26,27)/t17-,18-/m0/s1