[4-(1,3-benzodioxol-5-yl)-3-[(2-cyanophenyl)methoxy]piperidin-1-yl] tert-butyl carbonate

Systemtic Name: [4-(1,3-benzodioxol-5-yl)-3-[(2-cyanophenyl)methoxy]piperidin-1-yl] tert-butyl carbonate Openeye Name: [4-(1,3-benzodioxol-5-yl)-3-[(2-cyanophenyl)methoxy]-1-piperidyl] tert-butyl carbonate CAS Name: carbonic acid [4-(1,3-benzodioxol-5-yl)-3-[(2-cyanophenyl)methoxy]-1-piperidinyl] tert-butyl ester IUPAC Name: [4-(1,3-benzodioxol-5-yl)-3-[(2-cyanophenyl)methoxy]piperidin-1-yl] tert-butyl carbonate Traditional Name: carbonic acid [4-(1,3-benzodioxol-5-yl)-3-(2-cyanobenzyl)oxy-piperidino] tert-butyl ester Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)ON1CCC(C(C1)OCC2=CC=CC=C2C#N)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(C)(C)OC(=O)ON1CCC(C(C1)OCC2=CC=CC=C2C#N)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C25H28N2O6/c1-25(2,3)32-24(28)33-27-11-10-20(17-8-9-21-22(12-17)31-16-30-21)23(14-27)29-15-19-7-5-4-6-18(19)13-26/h4-9,12,20,23H,10-11,14-16H2,1-3H3