3-(dibutylamino)-1-(2,5-diphenylfuran-3-yl)propan-1-one hydrochloride

Systemtic Name: 3-(dibutylamino)-1-(2,5-diphenylfuran-3-yl)propan-1-one hydrochloride Openeye Name: 3-(dibutylamino)-1-(2,5-diphenyl-3-furyl)propan-1-one hydrochloride CAS Name: 3-(dibutylamino)-1-(2,5-diphenyl-3-furanyl)-1-propanone hydrochloride IUPAC Name: 3-(dibutylamino)-1-(2,5-diphenylfuran-3-yl)propan-1-one hydrochloride Traditional Name: 3-(dibutylamino)-1-(2,5-diphenyl-3-furyl)propan-1-one hydrochloride Formula: C27H34ClNO2 MolecularWeight: 440.01736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCC(=O)C1=C(OC(=C1)C2=CC=CC=C2)C3=CC=CC=C3.Cl

Isomeric SMILES

CCCCN(CCCC)CCC(=O)C1=C(OC(=C1)C2=CC=CC=C2)C3=CC=CC=C3.Cl

InChI

InChI=1S/C27H33NO2.ClH/c1-3-5-18-28(19-6-4-2)20-17-25(29)24-21-26(22-13-9-7-10-14-22)30-27(24)23-15-11-8-12-16-23;/h7-16,21H,3-6,17-20H2,1-2H3;1H