ethanedioic acid; 1-[(2-methylphenyl)-phenyl-methoxy]-3-(pyridin-2-ylmethylamino)propan-2-ol

Systemtic Name: ethanedioic acid; 1-[(2-methylphenyl)-phenyl-methoxy]-3-(pyridin-2-ylmethylamino)propan-2-ol Openeye Name: 1-[o-tolyl(phenyl)methoxy]-3-(2-pyridylmethylamino)propan-2-ol; oxalic acid CAS Name: 1-[(2-methylphenyl)-phenylmethoxy]-3-(2-pyridinylmethylamino)-2-propanol; oxalic acid IUPAC Name: 1-[(2-methylphenyl)-phenylmethoxy]-3-(pyridin-2-ylmethylamino)propan-2-ol; oxalic acid Traditional Name: 1-[o-tolyl(phenyl)methoxy]-3-(2-pyridylmethylamino)propan-2-ol; oxalic acid Formula: C25H28N2O6 MolecularWeight: 452.49962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC=CC=C2)OCC(CNCC3=CC=CC=N3)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC=CC=C2)OCC(CNCC3=CC=CC=N3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H26N2O2.C2H2O4/c1-18-9-5-6-13-22(18)23(19-10-3-2-4-11-19)27-17-21(26)16-24-15-20-12-7-8-14-25-20;3-1(4)2(5)6/h2-14,21,23-24,26H,15-17H2,1H3;(H,3,4)(H,5,6)