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

Systemtic Name: 1-[3-[bis(4-fluorophenyl)methylidene]-2-piperidin-1-yl-pyrrolidin-1-yl]butan-1-one; methanesulfonic acid Openeye Name: 1-[3-[bis(4-fluorophenyl)methylene]-2-(1-piperidyl)pyrrolidin-1-yl]butan-1-one; methanesulfonic acid CAS Name: 1-[3-[bis(4-fluorophenyl)methylidene]-2-(1-piperidinyl)-1-pyrrolidinyl]-1-butanone; methanesulfonic acid IUPAC Name: 1-[3-[bis(4-fluorophenyl)methylidene]-2-piperidin-1-ylpyrrolidin-1-yl]butan-1-one; methanesulfonic acid Traditional Name: 1-[3-[bis(4-fluorophenyl)methylene]-2-piperidino-pyrrolidino]butan-1-one; mesylic acid Formula: C27H34F2N2O4S MolecularWeight: 520.631666

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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.CS(=O)(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C26H30F2N2O.CH4O3S/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;1-5(2,3)4/h7-14,26H,2-6,15-18H2,1H3;1H3,(H,2,3,4)