2-isoquinolin-2-ium-2-yl-1-(3-nitrophenyl)ethanone

Systemtic Name: 2-isoquinolin-2-ium-2-yl-1-(3-nitrophenyl)ethanone Openeye Name: 2-isoquinolin-2-ium-2-yl-1-(3-nitrophenyl)ethanone CAS Name: 2-(2-isoquinolin-2-iumyl)-1-(3-nitrophenyl)ethanone IUPAC Name: 2-isoquinolin-2-ium-2-yl-1-(3-nitrophenyl)ethanone Traditional Name: 2-isoquinolin-2-ium-2-yl-1-(3-nitrophenyl)ethanone Formula: C17H13N2O3+ MolecularWeight: 293.29672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=[N+](C=CC2=C1)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N2O3/c20-17(14-6-3-7-16(10-14)19(21)22)12-18-9-8-13-4-1-2-5-15(13)11-18/h1-11H,12H2/q+1