[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl] 2-chloranyl-5-nitro-benzoate

Systemtic Name: [2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl] 2-chloranyl-5-nitro-benzoate Openeye Name: [2-oxo-2-(4-phenoxyanilino)ethyl] 2-chloro-5-nitro-benzoate CAS Name: 2-chloro-5-nitrobenzoic acid [2-oxo-2-(4-phenoxyanilino)ethyl] ester IUPAC Name: [2-oxo-2-(4-phenoxyanilino)ethyl] 2-chloro-5-nitrobenzoate Traditional Name: 2-chloro-5-nitro-benzoic acid [2-keto-2-(4-phenoxyanilino)ethyl] ester Formula: C21H15ClN2O6 MolecularWeight: 426.8066

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H15ClN2O6/c22-19-11-8-15(24(27)28)12-18(19)21(26)29-13-20(25)23-14-6-9-17(10-7-14)30-16-4-2-1-3-5-16/h1-12H,13H2,(H,23,25)