2-isoquinolin-2-ium-2-yl-1-(4-nitrophenyl)-3-phenyl-propane-1,3-dione

Systemtic Name: 2-isoquinolin-2-ium-2-yl-1-(4-nitrophenyl)-3-phenyl-propane-1,3-dione Openeye Name: 2-isoquinolin-2-ium-2-yl-1-(4-nitrophenyl)-3-phenyl-propane-1,3-dione CAS Name: 2-(2-isoquinolin-2-iumyl)-1-(4-nitrophenyl)-3-phenylpropane-1,3-dione IUPAC Name: 2-isoquinolin-2-ium-2-yl-1-(4-nitrophenyl)-3-phenylpropane-1,3-dione Traditional Name: 2-isoquinolin-2-ium-2-yl-1-(4-nitrophenyl)-3-phenyl-propane-1,3-dione Formula: C24H17N2O4+ MolecularWeight: 397.40278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C(C(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+]3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C(C(=O)C2=CC=C(C=C2)[N+](=O)[O-])[N+]3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C24H17N2O4/c27-23(18-7-2-1-3-8-18)22(24(28)19-10-12-21(13-11-19)26(29)30)25-15-14-17-6-4-5-9-20(17)16-25/h1-16,22H/q+1