2-[[2-(2,2-dimethylpropanoyloxy)-3-phenyl-propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-[[2-(2,2-dimethylpropanoyloxy)-3-phenyl-propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[[2-(2,2-dimethylpropanoyloxy)-3-phenyl-propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[2-(2,2-dimethyl-1-oxopropoxy)-1-oxo-3-phenylpropyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[[2-(2,2-dimethylpropanoyloxy)-3-phenylpropanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 3-(1H-imidazol-5-yl)-2-[(3-phenyl-2-pivaloyloxy-propanoyl)amino]propionic acid Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC(CC1=CC=CC=C1)C(=O)NC(CC2=CN=CN2)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)OC(CC1=CC=CC=C1)C(=O)NC(CC2=CN=CN2)C(=O)O

InChI

InChI=1S/C20H25N3O5/c1-20(2,3)19(27)28-16(9-13-7-5-4-6-8-13)17(24)23-15(18(25)26)10-14-11-21-12-22-14/h4-8,11-12,15-16H,9-10H2,1-3H3,(H,21,22)(H,23,24)(H,25,26)