O1-tert-butyl O4-methyl 4-[(3-pyridin-3-yl-1,2-oxazol-5-yl)methyl]piperidine-1,4-dicarboxylate

Systemtic Name: O1-tert-butyl O4-methyl 4-[(3-pyridin-3-yl-1,2-oxazol-5-yl)methyl]piperidine-1,4-dicarboxylate Openeye Name: O1-tert-butyl O4-methyl 4-[[3-(3-pyridyl)isoxazol-5-yl]methyl]piperidine-1,4-dicarboxylate CAS Name: 4-[[3-(3-pyridinyl)-5-isoxazolyl]methyl]piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-methyl ester IUPAC Name: 1-O-tert-butyl 4-O-methyl 4-[(3-pyridin-3-yl-1,2-oxazol-5-yl)methyl]piperidine-1,4-dicarboxylate Traditional Name: 4-[[3-(3-pyridyl)isoxazol-5-yl]methyl]piperidine-1,4-dicarboxylic acid O1-tert-butyl ester O4-methyl ester Formula: C21H27N3O5 MolecularWeight: 401.45618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(CC2=CC(=NO2)C3=CN=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(CC2=CC(=NO2)C3=CN=CC=C3)C(=O)OC

InChI

InChI=1S/C21H27N3O5/c1-20(2,3)28-19(26)24-10-7-21(8-11-24,18(25)27-4)13-16-12-17(23-29-16)15-6-5-9-22-14-15/h5-6,9,12,14H,7-8,10-11,13H2,1-4H3