1-(4-fluorophenyl)-1-[1-[4-(5-methyl-1H-indol-3-yl)butylamino]propyl]-3H-2-benzofuran-5-carbonitrile

Systemtic Name: 1-(4-fluorophenyl)-1-[1-[4-(5-methyl-1H-indol-3-yl)butylamino]propyl]-3H-2-benzofuran-5-carbonitrile Openeye Name: 1-(4-fluorophenyl)-1-[1-[4-(5-methyl-1H-indol-3-yl)butylamino]propyl]-3H-isobenzofuran-5-carbonitrile CAS Name: 1-(4-fluorophenyl)-1-[1-[4-(5-methyl-1H-indol-3-yl)butylamino]propyl]-3H-isobenzofuran-5-carbonitrile IUPAC Name: 1-(4-fluorophenyl)-1-[1-[4-(5-methyl-1H-indol-3-yl)butylamino]propyl]-3H-2-benzofuran-5-carbonitrile Traditional Name: 1-(4-fluorophenyl)-1-[1-[4-(5-methyl-1H-indol-3-yl)butylamino]propyl]phthalan-5-carbonitrile Formula: C31H32FN3O MolecularWeight: 481.603683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F)NCCCCC4=CNC5=C4C=C(C=C5)C

Isomeric SMILES

CCC(C1(C2=C(CO1)C=C(C=C2)C#N)C3=CC=C(C=C3)F)NCCCCC4=CNC5=C4C=C(C=C5)C

InChI

InChI=1S/C31H32FN3O/c1-3-30(34-15-5-4-6-23-19-35-29-14-7-21(2)16-27(23)29)31(25-9-11-26(32)12-10-25)28-13-8-22(18-33)17-24(28)20-36-31/h7-14,16-17,19,30,34-35H,3-6,15,20H2,1-2H3