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

Systemtic Name: ethanedioic acid; [3-oxidanylidene-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-1H-isoindol-1-yl] ethanoate Openeye Name: oxalic acid; [3-oxo-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]isoindolin-1-yl] acetate CAS Name: acetic acid [3-oxo-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-1H-isoindol-1-yl] ester; oxalic acid IUPAC Name: oxalic acid; [3-oxo-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-1H-isoindol-1-yl] acetate Traditional Name: acetic acid [3-keto-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]isoindolin-1-yl] ester; oxalic acid Formula: C26H28N2O7 MolecularWeight: 480.50972

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C2=CC=CC=C2C(=O)N1CCCN3CCC(=CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CC(=O)OC1C2=CC=CC=C2C(=O)N1CCCN3CCC(=CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H26N2O3.C2H2O4/c1-18(27)29-24-22-11-6-5-10-21(22)23(28)26(24)15-7-14-25-16-12-20(13-17-25)19-8-3-2-4-9-19;3-1(4)2(5)6/h2-6,8-12,24H,7,13-17H2,1H3;(H,3,4)(H,5,6)