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ethanedioic acid; methyl 4-[3-(butan-2-ylamino)propoxy]benzoate

ethanedioic acid; methyl 4-[3-(butan-2-ylamino)propoxy]benzoate

Systemtic Name:ethanedioic acid; methyl 4-[3-(butan-2-ylamino)propoxy]benzoate
Openeye Name:methyl 4-[3-(sec-butylamino)propoxy]benzoate; oxalic acid
CAS Name:4-[3-(butan-2-ylamino)propoxy]benzoic acid methyl ester; oxalic acid
IUPAC Name:methyl 4-[3-(butan-2-ylamino)propoxy]benzoate; oxalic acid
Traditional Name:oxalic acid; 4-[3-(sec-butylamino)propoxy]benzoic acid methyl ester
Formula: C17H25NO7
MolecularWeight: 355.3829
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NCCCOC1=CC=C(C=C1)C(=O)OC.C(=O)(C(=O)O)O


Isomeric SMILES

CCC(C)NCCCOC1=CC=C(C=C1)C(=O)OC.C(=O)(C(=O)O)O


InChI

InChI=1S/C15H23NO3.C2H2O4/c1-4-12(2)16-10-5-11-19-14-8-6-13(7-9-14)15(17)18-3;3-1(4)2(5)6/h6-9,12,16H,4-5,10-11H2,1-3H3;(H,3,4)(H,5,6)


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