methyl 4-[3-oxidanylidene-4-(phenylmethyl)-1,2-oxazol-5-yl]piperidine-1-carboxylate

Systemtic Name: methyl 4-[3-oxidanylidene-4-(phenylmethyl)-1,2-oxazol-5-yl]piperidine-1-carboxylate Openeye Name: methyl 4-(4-benzyl-3-oxo-isoxazol-5-yl)piperidine-1-carboxylate CAS Name: 4-[3-oxo-4-(phenylmethyl)-5-isoxazolyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-benzyl-3-oxo-1,2-oxazol-5-yl)piperidine-1-carboxylate Traditional Name: 4-(4-benzyl-3-keto-4-isoxazolin-5-yl)piperidine-1-carboxylic acid methyl ester Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(CC1)C2=C(C(=O)NO2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)N1CCC(CC1)C2=C(C(=O)NO2)CC3=CC=CC=C3

InChI

InChI=1S/C17H20N2O4/c1-22-17(21)19-9-7-13(8-10-19)15-14(16(20)18-23-15)11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H,18,20)