ethanedioic acid; 3-[[3-[(2-methoxyphenoxy)methyl]pyrrolidin-1-yl]methyl]-1H-pyrazin-2-one

Systemtic Name: ethanedioic acid; 3-[[3-[(2-methoxyphenoxy)methyl]pyrrolidin-1-yl]methyl]-1H-pyrazin-2-one Openeye Name: 3-[[3-[(2-methoxyphenoxy)methyl]pyrrolidin-1-yl]methyl]-1H-pyrazin-2-one; oxalic acid CAS Name: 3-[[3-[(2-methoxyphenoxy)methyl]-1-pyrrolidinyl]methyl]-1H-pyrazin-2-one; oxalic acid IUPAC Name: 3-[[3-[(2-methoxyphenoxy)methyl]pyrrolidin-1-yl]methyl]-1H-pyrazin-2-one; oxalic acid Traditional Name: 3-[[3-[(2-methoxyphenoxy)methyl]pyrrolidino]methyl]-1H-pyrazin-2-one; oxalic acid Formula: C19H23N3O7 MolecularWeight: 405.40182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC2CCN(C2)CC3=NC=CNC3=O.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1OCC2CCN(C2)CC3=NC=CNC3=O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H21N3O3.C2H2O4/c1-22-15-4-2-3-5-16(15)23-12-13-6-9-20(10-13)11-14-17(21)19-8-7-18-14;3-1(4)2(5)6/h2-5,7-8,13H,6,9-12H2,1H3,(H,19,21);(H,3,4)(H,5,6)