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

Systemtic Name: butyl 4-[2-[(2-methoxy-5-nitro-phenyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: butyl 4-[2-(2-methoxy-5-nitro-anilino)-2-oxo-ethoxy]benzoate CAS Name: 4-[2-(2-methoxy-5-nitroanilino)-2-oxoethoxy]benzoic acid butyl ester IUPAC Name: butyl 4-[2-(2-methoxy-5-nitroanilino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-keto-2-(2-methoxy-5-nitro-anilino)ethoxy]benzoic acid butyl ester Formula: C20H22N2O7 MolecularWeight: 402.39788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O7/c1-3-4-11-28-20(24)14-5-8-16(9-6-14)29-13-19(23)21-17-12-15(22(25)26)7-10-18(17)27-2/h5-10,12H,3-4,11,13H2,1-2H3,(H,21,23)