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ethanedioic acid; 1-(3-ethylphenoxy)-3-(phenethylamino)propan-2-ol

ethanedioic acid; 1-(3-ethylphenoxy)-3-(phenethylamino)propan-2-ol

Systemtic Name:ethanedioic acid; 1-(3-ethylphenoxy)-3-(phenethylamino)propan-2-ol
Openeye Name:1-(3-ethylphenoxy)-3-(phenethylamino)propan-2-ol; oxalic acid
CAS Name:1-(3-ethylphenoxy)-3-(phenethylamino)-2-propanol; oxalic acid
IUPAC Name:1-(3-ethylphenoxy)-3-(phenethylamino)propan-2-ol; oxalic acid
Traditional Name:1-(3-ethylphenoxy)-3-(phenethylamino)propan-2-ol; oxalic acid
Formula: C21H27NO6
MolecularWeight: 389.44218
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OCC(CNCCC2=CC=CC=C2)O.C(=O)(C(=O)O)O


Isomeric SMILES

CCC1=CC(=CC=C1)OCC(CNCCC2=CC=CC=C2)O.C(=O)(C(=O)O)O


InChI

InChI=1S/C19H25NO2.C2H2O4/c1-2-16-9-6-10-19(13-16)22-15-18(21)14-20-12-11-17-7-4-3-5-8-17;3-1(4)2(5)6/h3-10,13,18,20-21H,2,11-12,14-15H2,1H3;(H,3,4)(H,5,6)


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