1-(4-fluorophenyl)-1-[3-[3-(2-methoxyphenoxy)propylamino]propyl]-3H-2-benzofuran-5-carbonitrile

Systemtic Name: 1-(4-fluorophenyl)-1-[3-[3-(2-methoxyphenoxy)propylamino]propyl]-3H-2-benzofuran-5-carbonitrile Openeye Name: 1-(4-fluorophenyl)-1-[3-[3-(2-methoxyphenoxy)propylamino]propyl]-3H-isobenzofuran-5-carbonitrile CAS Name: 1-(4-fluorophenyl)-1-[3-[3-(2-methoxyphenoxy)propylamino]propyl]-3H-isobenzofuran-5-carbonitrile IUPAC Name: 1-(4-fluorophenyl)-1-[3-[3-(2-methoxyphenoxy)propylamino]propyl]-3H-2-benzofuran-5-carbonitrile Traditional Name: 1-(4-fluorophenyl)-1-[3-[3-(2-methoxyphenoxy)propylamino]propyl]phthalan-5-carbonitrile Formula: C28H29FN2O3 MolecularWeight: 460.539863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCCCNCCCC2(C3=C(CO2)C=C(C=C3)C#N)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC=CC=C1OCCCNCCCC2(C3=C(CO2)C=C(C=C3)C#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H29FN2O3/c1-32-26-6-2-3-7-27(26)33-17-5-16-31-15-4-14-28(23-9-11-24(29)12-10-23)25-13-8-21(19-30)18-22(25)20-34-28/h2-3,6-13,18,31H,4-5,14-17,20H2,1H3