[(2R)-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl] 1,3-benzothiazole-6-carboxylate

Systemtic Name: [(2R)-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-1-oxidanylidene-propan-2-yl] 1,3-benzothiazole-6-carboxylate Openeye Name: [(1R)-2-[(2R,6S)-2,6-dimethyl-1-piperidyl]-1-methyl-2-oxo-ethyl] 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid [(2R)-1-[(2R,6S)-2,6-dimethyl-1-piperidinyl]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]-1-oxopropan-2-yl] 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid [(1R)-2-[(2R,6S)-2,6-dimethylpiperidino]-2-keto-1-methyl-ethyl] ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)C(C)OC(=O)C2=CC3=C(C=C2)N=CS3)C

Isomeric SMILES

C[C@@H]1CCC[C@@H](N1C(=O)[C@@H](C)OC(=O)C2=CC3=C(C=C2)N=CS3)C

InChI

InChI=1S/C18H22N2O3S/c1-11-5-4-6-12(2)20(11)17(21)13(3)23-18(22)14-7-8-15-16(9-14)24-10-19-15/h7-13H,4-6H2,1-3H3/t11-,12+,13-/m1/s1