1-[4-(4-butoxybutoxy)-3-ethyl-phenyl]-3-(dibutylamino)propan-1-one hydrochloride

Systemtic Name: 1-[4-(4-butoxybutoxy)-3-ethyl-phenyl]-3-(dibutylamino)propan-1-one hydrochloride Openeye Name: 1-[4-(4-butoxybutoxy)-3-ethyl-phenyl]-3-(dibutylamino)propan-1-one hydrochloride CAS Name: 1-[4-(4-butoxybutoxy)-3-ethylphenyl]-3-(dibutylamino)-1-propanone hydrochloride IUPAC Name: 1-[4-(4-butoxybutoxy)-3-ethylphenyl]-3-(dibutylamino)propan-1-one hydrochloride Traditional Name: 1-[4-(4-butoxybutoxy)-3-ethyl-phenyl]-3-(dibutylamino)propan-1-one hydrochloride Formula: C27H48ClNO3 MolecularWeight: 470.12792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCC(=O)C1=CC(=C(C=C1)OCCCCOCCCC)CC.Cl

Isomeric SMILES

CCCCN(CCCC)CCC(=O)C1=CC(=C(C=C1)OCCCCOCCCC)CC.Cl

InChI

InChI=1S/C27H47NO3.ClH/c1-5-9-17-28(18-10-6-2)19-16-26(29)25-14-15-27(24(8-4)23-25)31-22-13-12-21-30-20-11-7-3;/h14-15,23H,5-13,16-22H2,1-4H3;1H