ethanedioic acid; methyl 2-[3-[(3-ethoxy-3-oxidanylidene-propyl)amino]-2-oxidanyl-propoxy]benzoate

Systemtic Name: ethanedioic acid; methyl 2-[3-[(3-ethoxy-3-oxidanylidene-propyl)amino]-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 2-[3-[(3-ethoxy-3-oxo-propyl)amino]-2-hydroxy-propoxy]benzoate; oxalic acid CAS Name: 2-[3-[(3-ethoxy-3-oxopropyl)amino]-2-hydroxypropoxy]benzoic acid methyl ester; oxalic acid IUPAC Name: methyl 2-[3-[(3-ethoxy-3-oxopropyl)amino]-2-hydroxypropoxy]benzoate; oxalic acid Traditional Name: 2-[3-[(3-ethoxy-3-keto-propyl)amino]-2-hydroxy-propoxy]benzoic acid methyl ester; oxalic acid Formula: C18H25NO10 MolecularWeight: 415.3918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNCC(COC1=CC=CC=C1C(=O)OC)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)CCNCC(COC1=CC=CC=C1C(=O)OC)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23NO6.C2H2O4/c1-3-22-15(19)8-9-17-10-12(18)11-23-14-7-5-4-6-13(14)16(20)21-2;3-1(4)2(5)6/h4-7,12,17-18H,3,8-11H2,1-2H3;(H,3,4)(H,5,6)