[5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-piperidin-4-yl] (E)-3-phenylprop-2-enoate dihydrochloride

Systemtic Name: [5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-piperidin-4-yl] (E)-3-phenylprop-2-enoate dihydrochloride Openeye Name: [5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-4-piperidyl] (E)-3-phenylprop-2-enoate dihydrochloride CAS Name: (E)-3-phenyl-2-propenoic 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] (E)-3-phenylprop-2-enoate dihydrochloride Traditional Name: (E)-3-phenylacrylic acid [5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-4-piperidyl] ester dihydrochloride Formula: C28H40Cl2N2O2 MolecularWeight: 507.5354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1(CN(C(CC1(C2=CC=CC=C2)OC(=O)C=CC3=CC=CC=C3)C)C)C.Cl.Cl

Isomeric SMILES

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

InChI

InChI=1S/C28H38N2O2.2ClH/c1-6-30(7-2)22-27(4)21-29(5)23(3)20-28(27,25-16-12-9-13-17-25)32-26(31)19-18-24-14-10-8-11-15-24;;/h8-19,23H,6-7,20-22H2,1-5H3;2*1H/b19-18+;;