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

Systemtic Name: ethanedioic acid; 3-[[3-[2-(2-methoxyphenyl)ethyl]pyrrolidin-1-yl]methyl]-1H-pyrazin-2-one Openeye Name: 3-[[3-[2-(2-methoxyphenyl)ethyl]pyrrolidin-1-yl]methyl]-1H-pyrazin-2-one; oxalic acid CAS Name: 3-[[3-[2-(2-methoxyphenyl)ethyl]-1-pyrrolidinyl]methyl]-1H-pyrazin-2-one; oxalic acid IUPAC Name: 3-[[3-[2-(2-methoxyphenyl)ethyl]pyrrolidin-1-yl]methyl]-1H-pyrazin-2-one; oxalic acid Traditional Name: 3-[[3-[2-(2-methoxyphenyl)ethyl]pyrrolidino]methyl]-1H-pyrazin-2-one; oxalic acid Formula: C20H25N3O6 MolecularWeight: 403.429

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCC2CCN(C2)CC3=NC=CNC3=O.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1CCC2CCN(C2)CC3=NC=CNC3=O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H23N3O2.C2H2O4/c1-23-17-5-3-2-4-15(17)7-6-14-8-11-21(12-14)13-16-18(22)20-10-9-19-16;3-1(4)2(5)6/h2-5,9-10,14H,6-8,11-13H2,1H3,(H,20,22);(H,3,4)(H,5,6)