ethanedioic acid; 3-ethoxy-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-3H-isoindol-1-one

Systemtic Name: ethanedioic acid; 3-ethoxy-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-3H-isoindol-1-one Openeye Name: 3-ethoxy-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]isoindolin-1-one; oxalic acid CAS Name: 3-ethoxy-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-3H-isoindol-1-one; oxalic acid IUPAC Name: 3-ethoxy-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-3H-isoindol-1-one; oxalic acid Traditional Name: 3-ethoxy-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]isoindolin-1-one; oxalic acid Formula: C26H30N2O6 MolecularWeight: 466.5262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1C2=CC=CC=C2C(=O)N1CCCN3CCC(=CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1C2=CC=CC=C2C(=O)N1CCCN3CCC(=CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H28N2O2.C2H2O4/c1-2-28-24-22-12-7-6-11-21(22)23(27)26(24)16-8-15-25-17-13-20(14-18-25)19-9-4-3-5-10-19;3-1(4)2(5)6/h3-7,9-13,24H,2,8,14-18H2,1H3;(H,3,4)(H,5,6)