O4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate

Systemtic Name: O4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate Openeye Name: O4-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl] O1-tert-butyl piperidine-1,4-dicarboxylate CAS Name: piperidine-1,4-dicarboxylic acid O4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] ester O1-tert-butyl ester IUPAC Name: 4-O-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl] 1-O-tert-butyl piperidine-1,4-dicarboxylate Traditional Name: piperidine-1,4-dicarboxylic acid O4-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl] ester O1-tert-butyl ester Formula: C20H26N2O7 MolecularWeight: 406.42964

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)OCC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)OCC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H26N2O7/c1-20(2,3)29-19(25)22-8-6-13(7-9-22)18(24)26-11-17(23)21-14-4-5-15-16(10-14)28-12-27-15/h4-5,10,13H,6-9,11-12H2,1-3H3,(H,21,23)