1'-Oxoestragole-DEA

1'-Oxoestragole-DEA is a theoretical adduct of 1'-oxoestragole and diethylamine.

Synonyms: 1'-Oxoestragole-diethylamine; 3-(diethylamino)-1-(4-methoxyphenyl)propan-1-one
Compound ID: 79653
Molecular Weight: 235.32204 [g/mol]
Molecular Formula: C14H21NO2
XLogP3-AA: 2.3
H-Bond Donor: 0
H-Bond Acceptor: 3
IUPAC Name: 3-(diethylamino)-1-(4-methoxyphenyl)propan-1-one
InChI: InChI=1S/C14H21NO2/c1-4-15(5-2)11-10-14(16)12-6-8-13(17-3)9-7-12/h6-9H,4-5,10-11H2,1-3H3
InChIKey: DSUDQWRYBRHEPO-UHFFFAOYSA-N
Canonical SMILES: CCN(CC)CCC(=O)C1=CC=C(C=C1)OC


See Also

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