butyl 4-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzoate

Systemtic Name: butyl 4-[(2R)-1-[(2-nitrophenyl)amino]-1-oxidanylidene-propan-2-yl]oxybenzoate Openeye Name: butyl 4-[(1R)-1-methyl-2-(2-nitroanilino)-2-oxo-ethoxy]benzoate CAS Name: 4-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]oxybenzoic acid butyl ester IUPAC Name: butyl 4-[(2R)-1-(2-nitroanilino)-1-oxopropan-2-yl]oxybenzoate Traditional Name: 4-[(1R)-2-keto-1-methyl-2-(2-nitroanilino)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)OC(C)C(=O)NC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O6/c1-3-4-13-27-20(24)15-9-11-16(12-10-15)28-14(2)19(23)21-17-7-5-6-8-18(17)22(25)26/h5-12,14H,3-4,13H2,1-2H3,(H,21,23)/t14-/m1/s1