3-(dibutylamino)-1-(3-ethyl-4-hexoxy-phenyl)propan-1-one hydrochloride

Systemtic Name: 3-(dibutylamino)-1-(3-ethyl-4-hexoxy-phenyl)propan-1-one hydrochloride Openeye Name: 3-(dibutylamino)-1-(3-ethyl-4-hexoxy-phenyl)propan-1-one hydrochloride CAS Name: 3-(dibutylamino)-1-(3-ethyl-4-hexoxyphenyl)-1-propanone hydrochloride IUPAC Name: 3-(dibutylamino)-1-(3-ethyl-4-hexoxyphenyl)propan-1-one hydrochloride Traditional Name: 3-(dibutylamino)-1-(3-ethyl-4-hexoxy-phenyl)propan-1-one hydrochloride Formula: C25H44ClNO2 MolecularWeight: 426.07536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)CCN(CCCC)CCCC)CC.Cl

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)CCN(CCCC)CCCC)CC.Cl

InChI

InChI=1S/C25H43NO2.ClH/c1-5-9-12-13-20-28-25-15-14-23(21-22(25)8-4)24(27)16-19-26(17-10-6-2)18-11-7-3;/h14-15,21H,5-13,16-20H2,1-4H3;1H