methyl 4-(3-oxidanylidene-4-phenethyl-1,2-oxazol-5-yl)piperidine-1-carboxylate

Systemtic Name: methyl 4-(3-oxidanylidene-4-phenethyl-1,2-oxazol-5-yl)piperidine-1-carboxylate Openeye Name: methyl 4-(3-oxo-4-phenethyl-isoxazol-5-yl)piperidine-1-carboxylate CAS Name: 4-(3-oxo-4-phenethyl-5-isoxazolyl)-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(3-oxo-4-phenethyl-1,2-oxazol-5-yl)piperidine-1-carboxylate Traditional Name: 4-(3-keto-4-phenethyl-4-isoxazolin-5-yl)piperidine-1-carboxylic acid methyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(CC1)C2=C(C(=O)NO2)CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)N1CCC(CC1)C2=C(C(=O)NO2)CCC3=CC=CC=C3

InChI

InChI=1S/C18H22N2O4/c1-23-18(22)20-11-9-14(10-12-20)16-15(17(21)19-24-16)8-7-13-5-3-2-4-6-13/h2-6,14H,7-12H2,1H3,(H,19,21)