2-cyano-2-(2-methyl-4-nitro-phenyl)ethanoic acid

Systemtic Name: 2-cyano-2-(2-methyl-4-nitro-phenyl)ethanoic acid Openeye Name: 2-cyano-2-(2-methyl-4-nitro-phenyl)acetic acid CAS Name: 2-cyano-2-(2-methyl-4-nitrophenyl)acetic acid IUPAC Name: 2-cyano-2-(2-methyl-4-nitrophenyl)acetic acid Traditional Name: 2-cyano-2-(2-methyl-4-nitro-phenyl)acetic acid Formula: C10H8N2O4 MolecularWeight: 220.18152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])C(C#N)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])C(C#N)C(=O)O

InChI

InChI=1S/C10H8N2O4/c1-6-4-7(12(15)16)2-3-8(6)9(5-11)10(13)14/h2-4,9H,1H3,(H,13,14)