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

Systemtic Name: (2S)-2-[[2-methyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[2-(benzyloxycarbonylamino)-2-methyl-propanoyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[2-methyl-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[2-methyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[2-(benzyloxycarbonylamino)-2-methyl-propanoyl]amino]-3-phenyl-propionic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O5/c1-21(2,23-20(27)28-14-16-11-7-4-8-12-16)19(26)22-17(18(24)25)13-15-9-5-3-6-10-15/h3-12,17H,13-14H2,1-2H3,(H,22,26)(H,23,27)(H,24,25)/t17-/m0/s1