(5S)-3-(4-dimethylaminophenyl)-4,5-dihydro-1,2-oxazole-5-carboxylate

Systemtic Name: (5S)-3-(4-dimethylaminophenyl)-4,5-dihydro-1,2-oxazole-5-carboxylate Openeye Name: (5S)-3-(4-dimethylaminophenyl)-4,5-dihydroisoxazole-5-carboxylate CAS Name: (5S)-3-(4-dimethylaminophenyl)-4,5-dihydroisoxazole-5-carboxylate IUPAC Name: (5S)-3-(4-dimethylaminophenyl)-4,5-dihydro-1,2-oxazole-5-carboxylate Traditional Name: (5S)-3-(4-dimethylaminophenyl)-2-isoxazoline-5-carboxylate Formula: C12H13N2O3- MolecularWeight: 233.24322

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=NOC(C2)C(=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=NO[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C12H14N2O3/c1-14(2)9-5-3-8(4-6-9)10-7-11(12(15)16)17-13-10/h3-6,11H,7H2,1-2H3,(H,15,16)/p-1/t11-/m0/s1