2-[2-[(E)-2-(3-methoxyphenyl)ethenyl]-4,5-dihydro-1,3-oxazol-3-ium-3-yl]ethanolate

Systemtic Name: 2-[2-[(E)-2-(3-methoxyphenyl)ethenyl]-4,5-dihydro-1,3-oxazol-3-ium-3-yl]ethanolate Openeye Name: 2-[2-[(E)-2-(3-methoxyphenyl)vinyl]-4,5-dihydrooxazol-3-ium-3-yl]ethanolate CAS Name: 2-[2-[(E)-2-(3-methoxyphenyl)ethenyl]-4,5-dihydrooxazol-3-ium-3-yl]ethanolate IUPAC Name: 2-[2-[(E)-2-(3-methoxyphenyl)ethenyl]-4,5-dihydro-1,3-oxazol-3-ium-3-yl]ethanolate Traditional Name: 2-[2-[(E)-2-(3-methoxyphenyl)vinyl]-2-oxazolin-3-ium-3-yl]ethanolate Formula: C14H17NO3 MolecularWeight: 247.28968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=CC2=[N+](CCO2)CC[O-]

Isomeric SMILES

COC1=CC=CC(=C1)/C=C/C2=[N+](CCO2)CC[O-]

InChI

InChI=1S/C14H17NO3/c1-17-13-4-2-3-12(11-13)5-6-14-15(7-9-16)8-10-18-14/h2-6,11H,7-10H2,1H3/b6-5+