3-(1H-imidazol-5-yl)-2-[[4-oxidanylidene-4-phenyl-2-(phenylmethyl)butanoyl]amino]propanoic acid

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[[4-oxidanylidene-4-phenyl-2-(phenylmethyl)butanoyl]amino]propanoic acid Openeye Name: 2-[(2-benzyl-4-oxo-4-phenyl-butanoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[1,4-dioxo-4-phenyl-2-(phenylmethyl)butyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[(2-benzyl-4-oxo-4-phenylbutanoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[(2-benzyl-4-keto-4-phenyl-butanoyl)amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(=O)C2=CC=CC=C2)C(=O)NC(CC3=CN=CN3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CC(=O)C2=CC=CC=C2)C(=O)NC(CC3=CN=CN3)C(=O)O

InChI

InChI=1S/C23H23N3O4/c27-21(17-9-5-2-6-10-17)12-18(11-16-7-3-1-4-8-16)22(28)26-20(23(29)30)13-19-14-24-15-25-19/h1-10,14-15,18,20H,11-13H2,(H,24,25)(H,26,28)(H,29,30)