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

Systemtic Name: 2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-2-phenyl-indene-1,3-dione Openeye Name: 2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-2-phenyl-indane-1,3-dione CAS Name: 2-[4-(4-nitrophenyl)-1-piperazin-1-iumyl]-2-phenylindene-1,3-dione IUPAC Name: 2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-2-phenylindene-1,3-dione Traditional Name: 2-[4-(4-nitrophenyl)piperazin-1-ium-1-yl]-2-phenyl-indane-1,3-quinone Formula: C25H22N3O4+ MolecularWeight: 428.45988

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1C2(C(=O)C3=CC=CC=C3C2=O)C4=CC=CC=C4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H21N3O4/c29-23-21-8-4-5-9-22(21)24(30)25(23,18-6-2-1-3-7-18)27-16-14-26(15-17-27)19-10-12-20(13-11-19)28(31)32/h1-13H,14-17H2/p+1