methyl 5-phenethyl-1,2-oxazole-3-carboxylate

Systemtic Name: methyl 5-phenethyl-1,2-oxazole-3-carboxylate Openeye Name: methyl 5-phenethylisoxazole-3-carboxylate CAS Name: 5-phenethyl-3-isoxazolecarboxylic acid methyl ester IUPAC Name: methyl 5-phenethyl-1,2-oxazole-3-carboxylate Traditional Name: 5-phenethylisoxazole-3-carboxylic acid methyl ester Formula: C13H13NO3 MolecularWeight: 231.24722

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NOC(=C1)CCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=NOC(=C1)CCC2=CC=CC=C2

InChI

InChI=1S/C13H13NO3/c1-16-13(15)12-9-11(17-14-12)8-7-10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3