methyl 3-nitro-4-[2-oxidanylidene-2-(2,3,4,5-tetramethylphenyl)ethoxy]benzoate

Systemtic Name: methyl 3-nitro-4-[2-oxidanylidene-2-(2,3,4,5-tetramethylphenyl)ethoxy]benzoate Openeye Name: methyl 3-nitro-4-[2-oxo-2-(2,3,4,5-tetramethylphenyl)ethoxy]benzoate CAS Name: 3-nitro-4-[2-oxo-2-(2,3,4,5-tetramethylphenyl)ethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-nitro-4-[2-oxo-2-(2,3,4,5-tetramethylphenyl)ethoxy]benzoate Traditional Name: 4-[2-keto-2-(2,3,4,5-tetramethylphenyl)ethoxy]-3-nitro-benzoic acid methyl ester Formula: C20H21NO6 MolecularWeight: 371.38384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-])C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)COC2=C(C=C(C=C2)C(=O)OC)[N+](=O)[O-])C)C)C

InChI

InChI=1S/C20H21NO6/c1-11-8-16(14(4)13(3)12(11)2)18(22)10-27-19-7-6-15(20(23)26-5)9-17(19)21(24)25/h6-9H,10H2,1-5H3