ethanedioic acid; ethyl 4-[2-oxidanyl-3-(oxolan-2-ylmethylamino)propoxy]benzoate

Systemtic Name: ethanedioic acid; ethyl 4-[2-oxidanyl-3-(oxolan-2-ylmethylamino)propoxy]benzoate Openeye Name: ethyl 4-[2-hydroxy-3-(tetrahydrofuran-2-ylmethylamino)propoxy]benzoate; oxalic acid CAS Name: 4-[2-hydroxy-3-(2-oxolanylmethylamino)propoxy]benzoic acid ethyl ester; oxalic acid IUPAC Name: ethyl 4-[2-hydroxy-3-(oxolan-2-ylmethylamino)propoxy]benzoate; oxalic acid Traditional Name: 4-[2-hydroxy-3-(tetrahydrofurfurylamino)propoxy]benzoic acid ethyl ester; oxalic acid Formula: C19H27NO9 MolecularWeight: 413.41898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(CNCC2CCCO2)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC(CNCC2CCCO2)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H25NO5.C2H2O4/c1-2-21-17(20)13-5-7-15(8-6-13)23-12-14(19)10-18-11-16-4-3-9-22-16;3-1(4)2(5)6/h5-8,14,16,18-19H,2-4,9-12H2,1H3;(H,3,4)(H,5,6)