tert-butyl 4-[4-[(5-cyano-1-benzofuran-2-yl)methyl]phenoxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(5-cyano-1-benzofuran-2-yl)methyl]phenoxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(5-cyanobenzofuran-2-yl)methyl]phenoxy]piperidine-1-carboxylate CAS Name: 4-[4-[(5-cyano-2-benzofuranyl)methyl]phenoxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(5-cyano-1-benzofuran-2-yl)methyl]phenoxy]piperidine-1-carboxylate Traditional Name: 4-[4-[(5-cyanobenzofuran-2-yl)methyl]phenoxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=C(C=C2)CC3=CC4=C(O3)C=CC(=C4)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=CC=C(C=C2)CC3=CC4=C(O3)C=CC(=C4)C#N

InChI

InChI=1S/C26H28N2O4/c1-26(2,3)32-25(29)28-12-10-22(11-13-28)30-21-7-4-18(5-8-21)15-23-16-20-14-19(17-27)6-9-24(20)31-23/h4-9,14,16,22H,10-13,15H2,1-3H3