3-(4-methoxy-1-benzofuran-2-yl)-3-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]propanenitrile

Systemtic Name: 3-(4-methoxy-1-benzofuran-2-yl)-3-oxidanylidene-2-[4-(phenylcarbonyl)piperazin-1-yl]propanenitrile Openeye Name: 2-(4-benzoylpiperazin-1-yl)-3-(4-methoxybenzofuran-2-yl)-3-oxo-propanenitrile CAS Name: 2-(4-benzoyl-1-piperazinyl)-3-(4-methoxy-2-benzofuranyl)-3-oxopropanenitrile IUPAC Name: 2-(4-benzoylpiperazin-1-yl)-3-(4-methoxy-1-benzofuran-2-yl)-3-oxopropanenitrile Traditional Name: 2-(4-benzoylpiperazino)-3-keto-3-(4-methoxybenzofuran-2-yl)propionitrile Formula: C23H21N3O4 MolecularWeight: 403.43054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C=C(O2)C(=O)C(C#N)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC2=C1C=C(O2)C(=O)C(C#N)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H21N3O4/c1-29-19-8-5-9-20-17(19)14-21(30-20)22(27)18(15-24)25-10-12-26(13-11-25)23(28)16-6-3-2-4-7-16/h2-9,14,18H,10-13H2,1H3