[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate

Systemtic Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Openeye Name: [2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-4-piperidinecarboxylic acid [2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)isonipecotic acid [2-(2,6-dimethylpiperidino)-2-keto-ethyl] ester Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)COC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)C

Isomeric SMILES

CC1CCCC(N1C(=O)COC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)C

InChI

InChI=1S/C22H29N3O4/c1-15-6-5-7-16(2)25(15)20(26)14-28-21(27)17-10-12-24(13-11-17)22-23-18-8-3-4-9-19(18)29-22/h3-4,8-9,15-17H,5-7,10-14H2,1-2H3