1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexanol citrate CAS Name: 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]-1-cyclohexanol; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 1-[2-(dimethylamino)-1-(4-methoxyphenyl)ethyl]cyclohexanol citrate Formula: C23H32NO9-3 MolecularWeight: 466.50148

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CN(C)CC(C1=CC=C(C=C1)OC)C2(CCCCC2)O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C17H27NO2.C6H8O7/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-10,16,19H,4-6,11-13H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3