[5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-piperidin-4-yl] benzoate dihydrochloride

Systemtic Name: [5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-piperidin-4-yl] benzoate dihydrochloride Openeye Name: [5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-4-piperidyl] benzoate dihydrochloride CAS Name: benzoic acid [5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-4-piperidinyl] ester dihydrochloride IUPAC Name: [5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenylpiperidin-4-yl] benzoate dihydrochloride Traditional Name: benzoic acid [5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-4-piperidyl] ester dihydrochloride Formula: C26H38Cl2N2O2 MolecularWeight: 481.49812

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1(CN(C(CC1(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C)C)C.Cl.Cl

Isomeric SMILES

CCN(CC)CC1(CN(C(CC1(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3)C)C)C.Cl.Cl

InChI

InChI=1S/C26H36N2O2.2ClH/c1-6-28(7-2)20-25(4)19-27(5)21(3)18-26(25,23-16-12-9-13-17-23)30-24(29)22-14-10-8-11-15-22;;/h8-17,21H,6-7,18-20H2,1-5H3;2*1H