2-[2-(2,3-dimethoxyphenyl)-3-(4-oxidanyl-4-phenyl-piperidin-1-yl)propyl]tetradecanenitrile hydrochloride

Systemtic Name: 2-[2-(2,3-dimethoxyphenyl)-3-(4-oxidanyl-4-phenyl-piperidin-1-yl)propyl]tetradecanenitrile hydrochloride Openeye Name: 2-[2-(2,3-dimethoxyphenyl)-3-(4-hydroxy-4-phenyl-1-piperidyl)propyl]tetradecanenitrile hydrochloride CAS Name: 2-[2-(2,3-dimethoxyphenyl)-3-(4-hydroxy-4-phenyl-1-piperidinyl)propyl]tetradecanenitrile hydrochloride IUPAC Name: 2-[2-(2,3-dimethoxyphenyl)-3-(4-hydroxy-4-phenylpiperidin-1-yl)propyl]tetradecanenitrile hydrochloride Traditional Name: 2-[2-(2,3-dimethoxyphenyl)-3-(4-hydroxy-4-phenyl-piperidino)propyl]myristonitrile hydrochloride Formula: C36H55ClN2O3 MolecularWeight: 599.2865

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC(CN1CCC(CC1)(C2=CC=CC=C2)O)C3=C(C(=CC=C3)OC)OC)C#N.Cl

Isomeric SMILES

CCCCCCCCCCCCC(CC(CN1CCC(CC1)(C2=CC=CC=C2)O)C3=C(C(=CC=C3)OC)OC)C#N.Cl

InChI

InChI=1S/C36H54N2O3.ClH/c1-4-5-6-7-8-9-10-11-12-14-18-30(28-37)27-31(33-21-17-22-34(40-2)35(33)41-3)29-38-25-23-36(39,24-26-38)32-19-15-13-16-20-32;/h13,15-17,19-22,30-31,39H,4-12,14,18,23-27,29H2,1-3H3;1H