tert-butyl 4-[[4-[5-(3-methoxy-3-oxidanylidene-propyl)-4,5-dihydro-1,2-oxazol-3-yl]phenoxy]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-[5-(3-methoxy-3-oxidanylidene-propyl)-4,5-dihydro-1,2-oxazol-3-yl]phenoxy]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-[5-(3-methoxy-3-oxo-propyl)-4,5-dihydroisoxazol-3-yl]phenoxy]methyl]piperidine-1-carboxylate CAS Name: 4-[[4-[5-(3-methoxy-3-oxopropyl)-4,5-dihydroisoxazol-3-yl]phenoxy]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-[5-(3-methoxy-3-oxopropyl)-4,5-dihydro-1,2-oxazol-3-yl]phenoxy]methyl]piperidine-1-carboxylate Traditional Name: 4-[[4-[5-(3-keto-3-methoxy-propyl)-2-isoxazolin-3-yl]phenoxy]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C24H34N2O6 MolecularWeight: 446.53656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC2=CC=C(C=C2)C3=NOC(C3)CCC(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC2=CC=C(C=C2)C3=NOC(C3)CCC(=O)OC

InChI

InChI=1S/C24H34N2O6/c1-24(2,3)31-23(28)26-13-11-17(12-14-26)16-30-19-7-5-18(6-8-19)21-15-20(32-25-21)9-10-22(27)29-4/h5-8,17,20H,9-16H2,1-4H3