2-(2,6-dimethyl-4-nitro-phenoxy)-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-(2,6-dimethyl-4-nitro-phenoxy)-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-(2,6-dimethyl-4-nitro-phenoxy)-1-pyrrolidin-1-yl-ethanone CAS Name: 2-(2,6-dimethyl-4-nitrophenoxy)-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-(2,6-dimethyl-4-nitrophenoxy)-1-pyrrolidin-1-ylethanone Traditional Name: 2-(2,6-dimethyl-4-nitro-phenoxy)-1-pyrrolidino-ethanone Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)N2CCCC2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N2CCCC2)C)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O4/c1-10-7-12(16(18)19)8-11(2)14(10)20-9-13(17)15-5-3-4-6-15/h7-8H,3-6,9H2,1-2H3