methyl 3-(5,5-diphenyl-4H-1,2-oxazol-2-ium-2-yl)propanoate

Systemtic Name: methyl 3-(5,5-diphenyl-4H-1,2-oxazol-2-ium-2-yl)propanoate Openeye Name: methyl 3-(5,5-diphenyl-4H-isoxazol-2-ium-2-yl)propanoate CAS Name: 3-(5,5-diphenyl-4H-isoxazol-2-ium-2-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(5,5-diphenyl-4H-1,2-oxazol-2-ium-2-yl)propanoate Traditional Name: 3-(5,5-diphenyl-2-isoxazolin-2-ium-2-yl)propionic acid methyl ester Formula: C19H20NO3+ MolecularWeight: 310.367

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC[N+]1=CCC(O1)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CC[N+]1=CCC(O1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H20NO3/c1-22-18(21)12-14-20-15-13-19(23-20,16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,15H,12-14H2,1H3/q+1