1-(2-nitro-5-pyrrolidin-1-yl-phenyl)ethanone

Systemtic Name: 1-(2-nitro-5-pyrrolidin-1-yl-phenyl)ethanone Openeye Name: 1-(2-nitro-5-pyrrolidin-1-yl-phenyl)ethanone CAS Name: 1-[2-nitro-5-(1-pyrrolidinyl)phenyl]ethanone IUPAC Name: 1-(2-nitro-5-pyrrolidin-1-ylphenyl)ethanone Traditional Name: 1-(2-nitro-5-pyrrolidino-phenyl)ethanone Formula: C12H14N2O3 MolecularWeight: 234.25116

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O3/c1-9(15)11-8-10(13-6-2-3-7-13)4-5-12(11)14(16)17/h4-5,8H,2-3,6-7H2,1H3