1-[3-[bis(4-fluorophenyl)methylidene]-2-piperidin-1-yl-pyrrolidin-1-yl]butan-1-one hydrochloride

Systemtic Name: 1-[3-[bis(4-fluorophenyl)methylidene]-2-piperidin-1-yl-pyrrolidin-1-yl]butan-1-one hydrochloride Openeye Name: 1-[3-[bis(4-fluorophenyl)methylene]-2-(1-piperidyl)pyrrolidin-1-yl]butan-1-one hydrochloride CAS Name: 1-[3-[bis(4-fluorophenyl)methylidene]-2-(1-piperidinyl)-1-pyrrolidinyl]-1-butanone hydrochloride IUPAC Name: 1-[3-[bis(4-fluorophenyl)methylidene]-2-piperidin-1-ylpyrrolidin-1-yl]butan-1-one hydrochloride Traditional Name: 1-[3-[bis(4-fluorophenyl)methylene]-2-piperidino-pyrrolidino]butan-1-one hydrochloride Formula: C26H31ClF2N2O MolecularWeight: 460.986946

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCC(=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C1N4CCCCC4.Cl

Isomeric SMILES

CCCC(=O)N1CCC(=C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C1N4CCCCC4.Cl

InChI

InChI=1S/C26H30F2N2O.ClH/c1-2-6-24(31)30-18-15-23(26(30)29-16-4-3-5-17-29)25(19-7-11-21(27)12-8-19)20-9-13-22(28)14-10-20;/h7-14,26H,2-6,15-18H2,1H3;1H