(2-oxidanylidene-2-piperidin-1-yl-ethyl) 4-(4-chloranyl-2-nitro-phenoxy)benzoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 4-(4-chloranyl-2-nitro-phenoxy)benzoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 4-(4-chloro-2-nitro-phenoxy)benzoate CAS Name: 4-(4-chloro-2-nitrophenoxy)benzoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 4-(4-chloro-2-nitrophenoxy)benzoate Traditional Name: 4-(4-chloro-2-nitro-phenoxy)benzoic acid (2-keto-2-piperidino-ethyl) ester Formula: C20H19ClN2O6 MolecularWeight: 418.82766

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)COC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)COC(=O)C2=CC=C(C=C2)OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClN2O6/c21-15-6-9-18(17(12-15)23(26)27)29-16-7-4-14(5-8-16)20(25)28-13-19(24)22-10-2-1-3-11-22/h4-9,12H,1-3,10-11,13H2