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

Systemtic Name: ethanedioic acid; 3-(methylamino)-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-3H-isoindol-1-one Openeye Name: 3-(methylamino)-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]isoindolin-1-one; oxalic acid CAS Name: 3-(methylamino)-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-3H-isoindol-1-one; oxalic acid IUPAC Name: 3-(methylamino)-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]-3H-isoindol-1-one; oxalic acid Traditional Name: 3-(methylamino)-2-[3-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)propyl]isoindolin-1-one; oxalic acid Formula: C25H29N3O5 MolecularWeight: 451.51486

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Descriptors Computed from Structure

Canonical SMILES:

CNC1C2=CC=CC=C2C(=O)N1CCCN3CCC(=CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CNC1C2=CC=CC=C2C(=O)N1CCCN3CCC(=CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H27N3O.C2H2O4/c1-24-22-20-10-5-6-11-21(20)23(27)26(22)15-7-14-25-16-12-19(13-17-25)18-8-3-2-4-9-18;3-1(4)2(5)6/h2-6,8-12,22,24H,7,13-17H2,1H3;(H,3,4)(H,5,6)