[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-4-piperidinecarboxylic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)isonipecotic acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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