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

Systemtic Name: 2-(2-chloranyl-4-nitro-phenoxy)-1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)ethanone Openeye Name: 2-(2-chloro-4-nitro-phenoxy)-1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)ethanone CAS Name: 2-(2-chloro-4-nitrophenoxy)-1-(1-ethyl-2,5-dimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-(2-chloro-4-nitrophenoxy)-1-(1-ethyl-2,5-dimethylpyrrol-3-yl)ethanone Traditional Name: 2-(2-chloro-4-nitro-phenoxy)-1-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)ethanone Formula: C16H17ClN2O4 MolecularWeight: 336.77018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)COC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C16H17ClN2O4/c1-4-18-10(2)7-13(11(18)3)15(20)9-23-16-6-5-12(19(21)22)8-14(16)17/h5-8H,4,9H2,1-3H3