2-(2-chloranyl-4-nitro-phenoxy)-1-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]ethanone

Systemtic Name: 2-(2-chloranyl-4-nitro-phenoxy)-1-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]ethanone Openeye Name: 2-(2-chloro-4-nitro-phenoxy)-1-(1-isopentyl-2,5-dimethyl-pyrrol-3-yl)ethanone CAS Name: 2-(2-chloro-4-nitrophenoxy)-1-[2,5-dimethyl-1-(3-methylbutyl)-3-pyrrolyl]ethanone IUPAC Name: 2-(2-chloro-4-nitrophenoxy)-1-[2,5-dimethyl-1-(3-methylbutyl)pyrrol-3-yl]ethanone Traditional Name: 2-(2-chloro-4-nitro-phenoxy)-1-(1-isoamyl-2,5-dimethyl-pyrrol-3-yl)ethanone Formula: C19H23ClN2O4 MolecularWeight: 378.84992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CCC(C)C)C)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=C(N1CCC(C)C)C)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H23ClN2O4/c1-12(2)7-8-21-13(3)9-16(14(21)4)18(23)11-26-19-6-5-15(22(24)25)10-17(19)20/h5-6,9-10,12H,7-8,11H2,1-4H3