(6-ethyl-2,3,6-trimethyl-2-phenethyl-piperidin-4-yl) 4-tert-butylbenzoate

Systemtic Name: (6-ethyl-2,3,6-trimethyl-2-phenethyl-piperidin-4-yl) 4-tert-butylbenzoate Openeye Name: (6-ethyl-2,3,6-trimethyl-2-phenethyl-4-piperidyl) 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid (6-ethyl-2,3,6-trimethyl-2-phenethyl-4-piperidinyl) ester IUPAC Name: (6-ethyl-2,3,6-trimethyl-2-phenethylpiperidin-4-yl) 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid (6-ethyl-2,3,6-trimethyl-2-phenethyl-4-piperidyl) ester Formula: C29H41NO2 MolecularWeight: 435.64134

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(C(C(N1)(C)CCC2=CC=CC=C2)C)OC(=O)C3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CCC1(CC(C(C(N1)(C)CCC2=CC=CC=C2)C)OC(=O)C3=CC=C(C=C3)C(C)(C)C)C

InChI

InChI=1S/C29H41NO2/c1-8-28(6)20-25(32-26(31)23-14-16-24(17-15-23)27(3,4)5)21(2)29(7,30-28)19-18-22-12-10-9-11-13-22/h9-17,21,25,30H,8,18-20H2,1-7H3