butyl 4-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: butyl 4-[2-[(2-methyl-5-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: butyl 4-[2-(2-methyl-5-nitro-anilino)-2-oxo-ethoxy]benzoate CAS Name: 4-[2-(2-methyl-5-nitroanilino)-2-oxoethoxy]benzoic acid butyl ester IUPAC Name: butyl 4-[2-(2-methyl-5-nitroanilino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-(2-methyl-5-nitro-anilino)ethoxy]benzoic acid butyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OCC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C20H22N2O6/c1-3-4-11-27-20(24)15-6-9-17(10-7-15)28-13-19(23)21-18-12-16(22(25)26)8-5-14(18)2/h5-10,12H,3-4,11,13H2,1-2H3,(H,21,23)