2-[2-[[2-(3-methoxy-3-oxidanylidene-propyl)phenyl]methyl]phenyl]-1,3-oxazole-4-carboxylic acid

Systemtic Name: 2-[2-[[2-(3-methoxy-3-oxidanylidene-propyl)phenyl]methyl]phenyl]-1,3-oxazole-4-carboxylic acid Openeye Name: 2-[2-[[2-(3-methoxy-3-oxo-propyl)phenyl]methyl]phenyl]oxazole-4-carboxylic acid CAS Name: 2-[2-[[2-(3-methoxy-3-oxopropyl)phenyl]methyl]phenyl]-4-oxazolecarboxylic acid IUPAC Name: 2-[2-[[2-(3-methoxy-3-oxopropyl)phenyl]methyl]phenyl]-1,3-oxazole-4-carboxylic acid Traditional Name: 2-[2-[2-(3-keto-3-methoxy-propyl)benzyl]phenyl]oxazole-4-carboxylic acid Formula: C21H19NO5 MolecularWeight: 365.37926

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=CC=C1CC2=CC=CC=C2C3=NC(=CO3)C(=O)O

Isomeric SMILES

COC(=O)CCC1=CC=CC=C1CC2=CC=CC=C2C3=NC(=CO3)C(=O)O

InChI

InChI=1S/C21H19NO5/c1-26-19(23)11-10-14-6-2-3-7-15(14)12-16-8-4-5-9-17(16)20-22-18(13-27-20)21(24)25/h2-9,13H,10-12H2,1H3,(H,24,25)