3-[5-(diphenylmethyl)oxy-2-(hydroxymethyl)-4-oxidanylidene-pyridin-1-yl]propanoic acid

Systemtic Name: 3-[5-(diphenylmethyl)oxy-2-(hydroxymethyl)-4-oxidanylidene-pyridin-1-yl]propanoic acid Openeye Name: 3-[5-benzhydryloxy-2-(hydroxymethyl)-4-oxo-1-pyridyl]propanoic acid CAS Name: 3-[5-(diphenylmethyl)oxy-2-(hydroxymethyl)-4-oxo-1-pyridinyl]propanoic acid IUPAC Name: 3-[5-benzhydryloxy-2-(hydroxymethyl)-4-oxopyridin-1-yl]propanoic acid Traditional Name: 3-(5-benzhydryloxy-4-keto-2-methylol-1-pyridyl)propionic acid Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC3=CN(C(=CC3=O)CO)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)OC3=CN(C(=CC3=O)CO)CCC(=O)O

InChI

InChI=1S/C22H21NO5/c24-15-18-13-19(25)20(14-23(18)12-11-21(26)27)28-22(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,13-14,22,24H,11-12,15H2,(H,26,27)