methyl 3-[[4-[2-[methyl-(4-propan-2-yloxyphenyl)amino]ethyl]-4-oxidanyl-piperidin-1-yl]methyl]benzoate dihydrochloride

Systemtic Name: methyl 3-[[4-[2-[methyl-(4-propan-2-yloxyphenyl)amino]ethyl]-4-oxidanyl-piperidin-1-yl]methyl]benzoate dihydrochloride Openeye Name: methyl 3-[[4-hydroxy-4-[2-(4-isopropoxy-N-methyl-anilino)ethyl]-1-piperidyl]methyl]benzoate dihydrochloride CAS Name: 3-[[4-hydroxy-4-[2-(N-methyl-4-propan-2-yloxyanilino)ethyl]-1-piperidinyl]methyl]benzoic acid methyl ester dihydrochloride IUPAC Name: methyl 3-[[4-hydroxy-4-[2-(N-methyl-4-propan-2-yloxyanilino)ethyl]piperidin-1-yl]methyl]benzoate dihydrochloride Traditional Name: 3-[[4-hydroxy-4-[2-(4-isopropoxy-N-methyl-anilino)ethyl]piperidino]methyl]benzoic acid methyl ester dihydrochloride Formula: C26H38Cl2N2O4 MolecularWeight: 513.49692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)N(C)CCC2(CCN(CC2)CC3=CC=CC(=C3)C(=O)OC)O.Cl.Cl

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)N(C)CCC2(CCN(CC2)CC3=CC=CC(=C3)C(=O)OC)O.Cl.Cl

InChI

InChI=1S/C26H36N2O4.2ClH/c1-20(2)32-24-10-8-23(9-11-24)27(3)15-12-26(30)13-16-28(17-14-26)19-21-6-5-7-22(18-21)25(29)31-4;;/h5-11,18,20,30H,12-17,19H2,1-4H3;2*1H