2-[3-(dimethoxymethyl)-4-nitro-phenyl]-2-thiophen-2-yl-ethanenitrile

Systemtic Name: 2-[3-(dimethoxymethyl)-4-nitro-phenyl]-2-thiophen-2-yl-ethanenitrile Openeye Name: 2-[3-(dimethoxymethyl)-4-nitro-phenyl]-2-(2-thienyl)acetonitrile CAS Name: 2-[3-(dimethoxymethyl)-4-nitrophenyl]-2-thiophen-2-ylacetonitrile IUPAC Name: 2-[3-(dimethoxymethyl)-4-nitrophenyl]-2-thiophen-2-ylacetonitrile Traditional Name: 2-[3-(dimethoxymethyl)-4-nitro-phenyl]-2-(2-thienyl)acetonitrile Formula: C15H14N2O4S MolecularWeight: 318.34766

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=C(C=CC(=C1)C(C#N)C2=CC=CS2)[N+](=O)[O-])OC

Isomeric SMILES

COC(C1=C(C=CC(=C1)C(C#N)C2=CC=CS2)[N+](=O)[O-])OC

InChI

InChI=1S/C15H14N2O4S/c1-20-15(21-2)11-8-10(5-6-13(11)17(18)19)12(9-16)14-4-3-7-22-14/h3-8,12,15H,1-2H3