3-[2-[4-(2-oxidanylidene-3H-1,3-benzoxazol-7-yl)piperazin-1-yl]ethyl]-1-benzofuran-5-carbonitrile

Systemtic Name: 3-[2-[4-(2-oxidanylidene-3H-1,3-benzoxazol-7-yl)piperazin-1-yl]ethyl]-1-benzofuran-5-carbonitrile Openeye Name: 3-[2-[4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperazin-1-yl]ethyl]benzofuran-5-carbonitrile CAS Name: 3-[2-[4-(2-oxo-3H-1,3-benzoxazol-7-yl)-1-piperazinyl]ethyl]-5-benzofurancarbonitrile IUPAC Name: 3-[2-[4-(2-oxo-3H-1,3-benzoxazol-7-yl)piperazin-1-yl]ethyl]-1-benzofuran-5-carbonitrile Traditional Name: 3-[2-[4-(2-keto-3H-1,3-benzoxazol-7-yl)piperazino]ethyl]benzofuran-5-carbonitrile Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=COC3=C2C=C(C=C3)C#N)C4=CC=CC5=C4OC(=O)N5

Isomeric SMILES

C1CN(CCN1CCC2=COC3=C2C=C(C=C3)C#N)C4=CC=CC5=C4OC(=O)N5

InChI

InChI=1S/C22H20N4O3/c23-13-15-4-5-20-17(12-15)16(14-28-20)6-7-25-8-10-26(11-9-25)19-3-1-2-18-21(19)29-22(27)24-18/h1-5,12,14H,6-11H2,(H,24,27)