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

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 2-chloranyl-4-nitro-benzoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid (2-keto-2-piperidino-ethyl) ester Formula: C14H15ClN2O5 MolecularWeight: 326.7323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15ClN2O5/c15-12-8-10(17(20)21)4-5-11(12)14(19)22-9-13(18)16-6-2-1-3-7-16/h4-5,8H,1-3,6-7,9H2