4-[[4-[4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[4-(2,3-dihydro-1H-inden-5-yl)-4-oxidanylidene-butanoyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(4-indan-5-yl-4-oxo-butanoyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[4-(2,3-dihydro-1H-inden-5-yl)-1,4-dioxobutyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[4-(2,3-dihydro-1H-inden-5-yl)-4-oxobutanoyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(4-indan-5-yl-4-keto-butanoyl)piperazino]methyl]benzonitrile Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)C(=O)CCC(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H27N3O2/c26-17-19-4-6-20(7-5-19)18-27-12-14-28(15-13-27)25(30)11-10-24(29)23-9-8-21-2-1-3-22(21)16-23/h4-9,16H,1-3,10-15,18H2