ethanedioic acid; 1-[3-[2-oxidanyl-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propoxy]phenyl]ethanone

Systemtic Name: ethanedioic acid; 1-[3-[2-oxidanyl-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propoxy]phenyl]ethanone Openeye Name: 1-[3-[2-hydroxy-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propoxy]phenyl]ethanone; oxalic acid CAS Name: 1-[3-[2-hydroxy-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propoxy]phenyl]ethanone; oxalic acid IUPAC Name: 1-[3-[2-hydroxy-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propoxy]phenyl]ethanone; oxalic acid Traditional Name: 1-[3-[2-hydroxy-3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propoxy]phenyl]ethanone; oxalic acid Formula: C24H27NO7 MolecularWeight: 441.47368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCC(CN2CCC(=CC2)C3=CC=CC=C3)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OCC(CN2CCC(=CC2)C3=CC=CC=C3)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H25NO3.C2H2O4/c1-17(24)20-8-5-9-22(14-20)26-16-21(25)15-23-12-10-19(11-13-23)18-6-3-2-4-7-18;3-1(4)2(5)6/h2-10,14,21,25H,11-13,15-16H2,1H3;(H,3,4)(H,5,6)