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ethanedioic acid; 4-[6-(oxolan-2-ylmethylamino)hexoxy]benzoic acid

ethanedioic acid; 4-[6-(oxolan-2-ylmethylamino)hexoxy]benzoic acid

Systemtic Name:ethanedioic acid; 4-[6-(oxolan-2-ylmethylamino)hexoxy]benzoic acid
Openeye Name:oxalic acid; 4-[6-(tetrahydrofuran-2-ylmethylamino)hexoxy]benzoic acid
CAS Name:oxalic acid; 4-[6-(2-oxolanylmethylamino)hexoxy]benzoic acid
IUPAC Name:oxalic acid; 4-[6-(oxolan-2-ylmethylamino)hexoxy]benzoic acid
Traditional Name:oxalic acid; 4-[6-(tetrahydrofurfurylamino)hexoxy]benzoic acid
Formula: C20H29NO8
MolecularWeight: 411.44616
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNCCCCCCOC2=CC=C(C=C2)C(=O)O.C(=O)(C(=O)O)O


Isomeric SMILES

C1CC(OC1)CNCCCCCCOC2=CC=C(C=C2)C(=O)O.C(=O)(C(=O)O)O


InChI

InChI=1S/C18H27NO4.C2H2O4/c20-18(21)15-7-9-16(10-8-15)22-12-4-2-1-3-11-19-14-17-6-5-13-23-17;3-1(4)2(5)6/h7-10,17,19H,1-6,11-14H2,(H,20,21);(H,3,4)(H,5,6)


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