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

Systemtic Name: (2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl) 4-chloranyl-2-nitro-benzoate Openeye Name: [2-oxo-1-phenyl-2-(1-piperidyl)ethyl] 4-chloro-2-nitro-benzoate CAS Name: 4-chloro-2-nitrobenzoic acid [2-oxo-1-phenyl-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-1-phenyl-2-piperidin-1-ylethyl) 4-chloro-2-nitrobenzoate Traditional Name: 4-chloro-2-nitro-benzoic acid (2-keto-1-phenyl-2-piperidino-ethyl) ester Formula: C20H19ClN2O5 MolecularWeight: 402.82826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN2O5/c21-15-9-10-16(17(13-15)23(26)27)20(25)28-18(14-7-3-1-4-8-14)19(24)22-11-5-2-6-12-22/h1,3-4,7-10,13,18H,2,5-6,11-12H2