[1-(2-acetyloxy-2-phenyl-ethyl)-2,6-diethyl-2,3,6-trimethyl-piperidin-4-yl] benzoate

Systemtic Name: [1-(2-acetyloxy-2-phenyl-ethyl)-2,6-diethyl-2,3,6-trimethyl-piperidin-4-yl] benzoate Openeye Name: [1-(2-acetoxy-2-phenyl-ethyl)-2,6-diethyl-2,3,6-trimethyl-4-piperidyl] benzoate CAS Name: benzoic acid [1-(2-acetyloxy-2-phenylethyl)-2,6-diethyl-2,3,6-trimethyl-4-piperidinyl] ester IUPAC Name: [1-(2-acetyloxy-2-phenylethyl)-2,6-diethyl-2,3,6-trimethylpiperidin-4-yl] benzoate Traditional Name: benzoic acid [1-(2-acetoxy-2-phenyl-ethyl)-2,6-diethyl-2,3,6-trimethyl-4-piperidyl] ester Formula: C29H39NO4 MolecularWeight: 465.62426

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC(C(C(N1CC(C2=CC=CC=C2)OC(=O)C)(C)CC)C)OC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CCC1(CC(C(C(N1CC(C2=CC=CC=C2)OC(=O)C)(C)CC)C)OC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C29H39NO4/c1-7-28(5)19-25(34-27(32)24-17-13-10-14-18-24)21(3)29(6,8-2)30(28)20-26(33-22(4)31)23-15-11-9-12-16-23/h9-18,21,25-26H,7-8,19-20H2,1-6H3