1-(2-nitrophenyl)ethanone; 1-(3-nitrophenyl)ethanone; 1-(4-nitrophenyl)ethanone

Systemtic Name: 1-(2-nitrophenyl)ethanone; 1-(3-nitrophenyl)ethanone; 1-(4-nitrophenyl)ethanone Openeye Name: 1-(2-nitrophenyl)ethanone; 1-(3-nitrophenyl)ethanone; 1-(4-nitrophenyl)ethanone CAS Name: 1-(2-nitrophenyl)ethanone; 1-(3-nitrophenyl)ethanone; 1-(4-nitrophenyl)ethanone IUPAC Name: 1-(2-nitrophenyl)ethanone; 1-(3-nitrophenyl)ethanone; 1-(4-nitrophenyl)ethanone Traditional Name: 1-(2-nitrophenyl)ethanone; 1-(3-nitrophenyl)ethanone; 1-(4-nitrophenyl)ethanone Formula: C24H21N3O9 MolecularWeight: 495.43824

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)[N+](=O)[O-].CC(=O)C1=CC(=CC=C1)[N+](=O)[O-].CC(=O)C1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)[N+](=O)[O-].CC(=O)C1=CC(=CC=C1)[N+](=O)[O-].CC(=O)C1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/3C8H7NO3/c1-6(10)7-2-4-8(5-3-7)9(11)12;1-6(10)7-3-2-4-8(5-7)9(11)12;1-6(10)7-4-2-3-5-8(7)9(11)12/h3*2-5H,1H3