2-(1H-imidazol-2-ylmethyl)-3-methyl-3-phenyl-2-(propanoylamino)butanoic acid

Systemtic Name: 2-(1H-imidazol-2-ylmethyl)-3-methyl-3-phenyl-2-(propanoylamino)butanoic acid Openeye Name: 2-(1H-imidazol-2-ylmethyl)-3-methyl-3-phenyl-2-(propanoylamino)butanoic acid CAS Name: 2-(1H-imidazol-2-ylmethyl)-3-methyl-2-(1-oxopropylamino)-3-phenylbutanoic acid IUPAC Name: 2-(1H-imidazol-2-ylmethyl)-3-methyl-3-phenyl-2-(propanoylamino)butanoic acid Traditional Name: 2-(1H-imidazol-2-ylmethyl)-3-methyl-3-phenyl-2-propionamido-butyric acid Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(CC1=NC=CN1)(C(=O)O)C(C)(C)C2=CC=CC=C2

Isomeric SMILES

CCC(=O)NC(CC1=NC=CN1)(C(=O)O)C(C)(C)C2=CC=CC=C2

InChI

InChI=1S/C18H23N3O3/c1-4-15(22)21-18(16(23)24,12-14-19-10-11-20-14)17(2,3)13-8-6-5-7-9-13/h5-11H,4,12H2,1-3H3,(H,19,20)(H,21,22)(H,23,24)