1-(4-fluorophenyl)-1-(2-pyrrolidin-1-ylethyl)-3H-2-benzofuran-5-carbonitrile

Systemtic Name: 1-(4-fluorophenyl)-1-(2-pyrrolidin-1-ylethyl)-3H-2-benzofuran-5-carbonitrile Openeye Name: 1-(4-fluorophenyl)-1-(2-pyrrolidin-1-ylethyl)-3H-isobenzofuran-5-carbonitrile CAS Name: 1-(4-fluorophenyl)-1-[2-(1-pyrrolidinyl)ethyl]-3H-isobenzofuran-5-carbonitrile IUPAC Name: 1-(4-fluorophenyl)-1-(2-pyrrolidin-1-ylethyl)-3H-2-benzofuran-5-carbonitrile Traditional Name: 1-(4-fluorophenyl)-1-(2-pyrrolidinoethyl)phthalan-5-carbonitrile Formula: C21H21FN2O MolecularWeight: 336.402643

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCC2(C3=C(CO2)C=C(C=C3)C#N)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCN(C1)CCC2(C3=C(CO2)C=C(C=C3)C#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN2O/c22-19-6-4-18(5-7-19)21(9-12-24-10-1-2-11-24)20-8-3-16(14-23)13-17(20)15-25-21/h3-8,13H,1-2,9-12,15H2