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

Systemtic Name: 3-(1H-imidazol-5-yl)-2-[[2-(naphthalen-1-ylmethyl)-3-phenyl-propanoyl]amino]propanoic acid Openeye Name: 2-[[2-benzyl-3-(1-naphthyl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 3-(1H-imidazol-5-yl)-2-[[2-(1-naphthalenylmethyl)-1-oxo-3-phenylpropyl]amino]propanoic acid IUPAC Name: 2-[(2-benzyl-3-naphthalen-1-ylpropanoyl)amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[[2-benzyl-3-(1-naphthyl)propanoyl]amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC2=CC=CC3=CC=CC=C32)C(=O)NC(CC4=CN=CN4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC(CC2=CC=CC3=CC=CC=C32)C(=O)NC(CC4=CN=CN4)C(=O)O

InChI

InChI=1S/C26H25N3O3/c30-25(29-24(26(31)32)15-22-16-27-17-28-22)21(13-18-7-2-1-3-8-18)14-20-11-6-10-19-9-4-5-12-23(19)20/h1-12,16-17,21,24H,13-15H2,(H,27,28)(H,29,30)(H,31,32)