2-(3-methylisoquinolin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone

Systemtic Name: 2-(3-methylisoquinolin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone Openeye Name: 2-(3-methylisoquinolin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone CAS Name: 2-(3-methyl-2-isoquinolin-2-iumyl)-1-(4-nitrophenyl)ethanone IUPAC Name: 2-(3-methylisoquinolin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone Traditional Name: 2-(3-methylisoquinolin-2-ium-2-yl)-1-(4-nitrophenyl)ethanone Formula: C18H15N2O3+ MolecularWeight: 307.3233

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C=[N+]1CC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=CC=CC=C2C=[N+]1CC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N2O3/c1-13-10-15-4-2-3-5-16(15)11-19(13)12-18(21)14-6-8-17(9-7-14)20(22)23/h2-11H,12H2,1H3/q+1