2-[[2-(imidazol-1-ylmethyl)-3-phenyl-propanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-(imidazol-1-ylmethyl)-3-phenyl-propanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[(2-benzyl-3-imidazol-1-yl-propanoyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(1-imidazolylmethyl)-1-oxo-3-phenylpropyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(2-benzyl-3-imidazol-1-ylpropanoyl)amino]-3-methylbutanoic acid Traditional Name: 2-[(2-benzyl-3-imidazol-1-yl-propanoyl)amino]-3-methyl-butyric acid Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C(CC1=CC=CC=C1)CN2C=CN=C2

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C(CC1=CC=CC=C1)CN2C=CN=C2

InChI

InChI=1S/C18H23N3O3/c1-13(2)16(18(23)24)20-17(22)15(11-21-9-8-19-12-21)10-14-6-4-3-5-7-14/h3-9,12-13,15-16H,10-11H2,1-2H3,(H,20,22)(H,23,24)