[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate

Systemtic Name: [1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Openeye Name: [2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-4-piperidinecarboxylic acid [1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-1-oxopropan-2-yl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)isonipecotic acid [2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(C(=O)NC(C)(C)C)OC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C20H27N3O4/c1-13(17(24)22-20(2,3)4)26-18(25)14-9-11-23(12-10-14)19-21-15-7-5-6-8-16(15)27-19/h5-8,13-14H,9-12H2,1-4H3,(H,22,24)