ethanedioic acid; 1-(3-methylphenoxy)-3-[[1-(phenylmethyl)piperidin-4-yl]amino]propan-2-ol

Systemtic Name: ethanedioic acid; 1-(3-methylphenoxy)-3-[[1-(phenylmethyl)piperidin-4-yl]amino]propan-2-ol Openeye Name: 1-[(1-benzyl-4-piperidyl)amino]-3-(3-methylphenoxy)propan-2-ol; oxalic acid CAS Name: 1-(3-methylphenoxy)-3-[[1-(phenylmethyl)-4-piperidinyl]amino]-2-propanol; oxalic acid IUPAC Name: 1-[(1-benzylpiperidin-4-yl)amino]-3-(3-methylphenoxy)propan-2-ol; oxalic acid Traditional Name: 1-[(1-benzyl-4-piperidyl)amino]-3-(3-methylphenoxy)propan-2-ol; oxalic acid Formula: C24H32N2O6 MolecularWeight: 444.52068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CNC2CCN(CC2)CC3=CC=CC=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)OCC(CNC2CCN(CC2)CC3=CC=CC=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H30N2O2.C2H2O4/c1-18-6-5-9-22(14-18)26-17-21(25)15-23-20-10-12-24(13-11-20)16-19-7-3-2-4-8-19;3-1(4)2(5)6/h2-9,14,20-21,23,25H,10-13,15-17H2,1H3;(H,3,4)(H,5,6)