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

Systemtic Name: [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenyl-piperidin-4-yl] benzoate dihydrochloride Openeye Name: [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenyl-4-piperidyl] benzoate dihydrochloride CAS Name: benzoic acid [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenyl-4-piperidinyl] ester dihydrochloride IUPAC Name: [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenylpiperidin-4-yl] benzoate dihydrochloride Traditional Name: benzoic acid [5-[(dipropylamino)methyl]-1,2,5-trimethyl-4-phenyl-4-piperidyl] ester dihydrochloride Formula: C28H42Cl2N2O2 MolecularWeight: 509.55128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H40N2O2.2ClH/c1-6-18-30(19-7-2)22-27(4)21-29(5)23(3)20-28(27,25-16-12-9-13-17-25)32-26(31)24-14-10-8-11-15-24;;/h8-17,23H,6-7,18-22H2,1-5H3;2*1H