O6-[2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)piperidin-4-yl] O1-methyl hexanedioate

Systemtic Name: O6-[2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)piperidin-4-yl] O1-methyl hexanedioate Openeye Name: O6-[2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)-4-piperidyl] O1-methyl hexanedioate CAS Name: hexanedioic acid O6-[2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)-4-piperidinyl] ester O1-methyl ester IUPAC Name: 6-O-[2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)piperidin-4-yl] 1-O-methyl hexanedioate Traditional Name: adipic acid O6-[2,2-diethyl-6,6-dimethyl-1-(1-phenylethoxy)-4-piperidyl] ester O1-methyl ester Formula: C26H41NO5 MolecularWeight: 447.60744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(CC(N1OC(C)C2=CC=CC=C2)(C)C)OC(=O)CCCCC(=O)OC)CC

Isomeric SMILES

CCC1(CC(CC(N1OC(C)C2=CC=CC=C2)(C)C)OC(=O)CCCCC(=O)OC)CC

InChI

InChI=1S/C26H41NO5/c1-7-26(8-2)19-22(31-24(29)17-13-12-16-23(28)30-6)18-25(4,5)27(26)32-20(3)21-14-10-9-11-15-21/h9-11,14-15,20,22H,7-8,12-13,16-19H2,1-6H3