ethanedioic acid; 2-[3-(2-methoxyphenoxy)pyrrolidin-1-yl]ethyl benzoate

Systemtic Name: ethanedioic acid; 2-[3-(2-methoxyphenoxy)pyrrolidin-1-yl]ethyl benzoate Openeye Name: 2-[3-(2-methoxyphenoxy)pyrrolidin-1-yl]ethyl benzoate; oxalic acid CAS Name: benzoic acid 2-[3-(2-methoxyphenoxy)-1-pyrrolidinyl]ethyl ester; oxalic acid IUPAC Name: 2-[3-(2-methoxyphenoxy)pyrrolidin-1-yl]ethyl benzoate; oxalic acid Traditional Name: benzoic acid 2-[3-(2-methoxyphenoxy)pyrrolidino]ethyl ester; oxalic acid Formula: C22H25NO8 MolecularWeight: 431.4358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OC2CCN(C2)CCOC(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC=C1OC2CCN(C2)CCOC(=O)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H23NO4.C2H2O4/c1-23-18-9-5-6-10-19(18)25-17-11-12-21(15-17)13-14-24-20(22)16-7-3-2-4-8-16;3-1(4)2(5)6/h2-10,17H,11-15H2,1H3;(H,3,4)(H,5,6)