tert-butyl 3-[(2-methyl-3a,7a-dihydro-1,3-benzothiazol-5-yl)oxymethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[(2-methyl-3a,7a-dihydro-1,3-benzothiazol-5-yl)oxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[(2-methyl-3a,7a-dihydro-1,3-benzothiazol-5-yl)oxymethyl]piperidine-1-carboxylate CAS Name: 3-[(2-methyl-3a,7a-dihydro-1,3-benzothiazol-5-yl)oxymethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[(2-methyl-3a,7a-dihydro-1,3-benzothiazol-5-yl)oxymethyl]piperidine-1-carboxylate Traditional Name: 3-[(2-methyl-3a,7a-dihydro-1,3-benzothiazol-5-yl)oxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H28N2O3S MolecularWeight: 364.50222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2C=C(C=CC2S1)OCC3CCCN(C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=NC2C=C(C=CC2S1)OCC3CCCN(C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H28N2O3S/c1-13-20-16-10-15(7-8-17(16)25-13)23-12-14-6-5-9-21(11-14)18(22)24-19(2,3)4/h7-8,10,14,16-17H,5-6,9,11-12H2,1-4H3