tert-butyl 3-[1-(1,3-benzodioxol-5-yl)ethylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[1-(1,3-benzodioxol-5-yl)ethylcarbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[1-(1,3-benzodioxol-5-yl)ethylcarbamoyl]piperidine-1-carboxylate CAS Name: 3-[[1-(1,3-benzodioxol-5-yl)ethylamino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[1-(1,3-benzodioxol-5-yl)ethylcarbamoyl]piperidine-1-carboxylate Traditional Name: 3-[1-(1,3-benzodioxol-5-yl)ethylcarbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H28N2O5 MolecularWeight: 376.44672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3CCCN(C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCO2)NC(=O)C3CCCN(C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H28N2O5/c1-13(14-7-8-16-17(10-14)26-12-25-16)21-18(23)15-6-5-9-22(11-15)19(24)27-20(2,3)4/h7-8,10,13,15H,5-6,9,11-12H2,1-4H3,(H,21,23)