ethanedioic acid; 4-[4-[2-(2-oxidanylpropylamino)ethoxy]phenyl]butan-2-one

Systemtic Name: ethanedioic acid; 4-[4-[2-(2-oxidanylpropylamino)ethoxy]phenyl]butan-2-one Openeye Name: 4-[4-[2-(2-hydroxypropylamino)ethoxy]phenyl]butan-2-one; oxalic acid CAS Name: 4-[4-[2-(2-hydroxypropylamino)ethoxy]phenyl]-2-butanone; oxalic acid IUPAC Name: 4-[4-[2-(2-hydroxypropylamino)ethoxy]phenyl]butan-2-one; oxalic acid Traditional Name: 4-[4-[2-(2-hydroxypropylamino)ethoxy]phenyl]butan-2-one; oxalic acid Formula: C17H25NO7 MolecularWeight: 355.3829

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNCCOC1=CC=C(C=C1)CCC(=O)C)O.C(=O)(C(=O)O)O

Isomeric SMILES

CC(CNCCOC1=CC=C(C=C1)CCC(=O)C)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H23NO3.C2H2O4/c1-12(17)3-4-14-5-7-15(8-6-14)19-10-9-16-11-13(2)18;3-1(4)2(5)6/h5-8,13,16,18H,3-4,9-11H2,1-2H3;(H,3,4)(H,5,6)