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

Systemtic Name: methyl 4-[3-oxidanylidene-4-(3-phenylpropyl)-1,2-oxazol-5-yl]piperidine-1-carboxylate Openeye Name: methyl 4-[3-oxo-4-(3-phenylpropyl)isoxazol-5-yl]piperidine-1-carboxylate CAS Name: 4-[3-oxo-4-(3-phenylpropyl)-5-isoxazolyl]-1-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 4-[3-oxo-4-(3-phenylpropyl)-1,2-oxazol-5-yl]piperidine-1-carboxylate Traditional Name: 4-[3-keto-4-(3-phenylpropyl)-4-isoxazolin-5-yl]piperidine-1-carboxylic acid methyl ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCC(CC1)C2=C(C(=O)NO2)CCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)N1CCC(CC1)C2=C(C(=O)NO2)CCCC3=CC=CC=C3

InChI

InChI=1S/C19H24N2O4/c1-24-19(23)21-12-10-15(11-13-21)17-16(18(22)20-25-17)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,15H,5,8-13H2,1H3,(H,20,22)