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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O5/c1-20(2,11-14-6-4-3-5-7-14)19(27)28-9-8-17(24)23-16(18(25)26)10-15-12-21-13-22-15/h3-7,12-13,16H,8-11H2,1-2H3,(H,21,22)(H,23,24)(H,25,26)