2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-2-phenyl-indene-1,3-dione

Systemtic Name: 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-2-phenyl-indene-1,3-dione Openeye Name: 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-2-phenyl-indane-1,3-dione CAS Name: 2-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-2-phenylindene-1,3-dione IUPAC Name: 2-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-2-phenylindene-1,3-dione Traditional Name: 2-[[4-(4-nitrophenyl)piperazino]methyl]-2-phenyl-indane-1,3-quinone Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H23N3O4/c30-24-22-8-4-5-9-23(22)25(31)26(24,19-6-2-1-3-7-19)18-27-14-16-28(17-15-27)20-10-12-21(13-11-20)29(32)33/h1-13H,14-18H2