2-methyl-2-[2-oxidanylidene-6-(phenylmethyl)-3-(3-phenylpropanoylamino)pyridin-1-yl]propanoic acid

Systemtic Name: 2-methyl-2-[2-oxidanylidene-6-(phenylmethyl)-3-(3-phenylpropanoylamino)pyridin-1-yl]propanoic acid Openeye Name: 2-[6-benzyl-2-oxo-3-(3-phenylpropanoylamino)-1-pyridyl]-2-methyl-propanoic acid CAS Name: 2-methyl-2-[2-oxo-3-[(1-oxo-3-phenylpropyl)amino]-6-(phenylmethyl)-1-pyridinyl]propanoic acid IUPAC Name: 2-[6-benzyl-2-oxo-3-(3-phenylpropanoylamino)pyridin-1-yl]-2-methylpropanoic acid Traditional Name: 2-[6-benzyl-3-(hydrocinnamoylamino)-2-keto-1-pyridyl]-2-methyl-propionic acid Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)N1C(=CC=C(C1=O)NC(=O)CCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C(=O)O)N1C(=CC=C(C1=O)NC(=O)CCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O4/c1-25(2,24(30)31)27-20(17-19-11-7-4-8-12-19)14-15-21(23(27)29)26-22(28)16-13-18-9-5-3-6-10-18/h3-12,14-15H,13,16-17H2,1-2H3,(H,26,28)(H,30,31)