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

Systemtic Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-4-yl)piperazin-1-yl]propyl]-3H-2-benzofuran-5-carbonitrile Openeye Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-4-yl)piperazin-1-yl]propyl]-3H-isobenzofuran-5-carbonitrile CAS Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-4-yl)-1-piperazinyl]propyl]-3H-isobenzofuran-5-carbonitrile IUPAC Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-4-yl)piperazin-1-yl]propyl]-3H-2-benzofuran-5-carbonitrile Traditional Name: 1-(4-fluorophenyl)-1-[3-[4-(1H-indol-4-yl)piperazino]propyl]phthalan-5-carbonitrile Formula: C30H29FN4O MolecularWeight: 480.575863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2(C3=C(CO2)C=C(C=C3)C#N)C4=CC=C(C=C4)F)C5=CC=CC6=C5C=CN6

Isomeric SMILES

C1CN(CCN1CCCC2(C3=C(CO2)C=C(C=C3)C#N)C4=CC=C(C=C4)F)C5=CC=CC6=C5C=CN6

InChI

InChI=1S/C30H29FN4O/c31-25-8-6-24(7-9-25)30(27-10-5-22(20-32)19-23(27)21-36-30)12-2-14-34-15-17-35(18-16-34)29-4-1-3-28-26(29)11-13-33-28/h1,3-11,13,19,33H,2,12,14-18,21H2