2-[3-(4-chloranyl-3-nitro-phenyl)-3-oxidanylidene-propyl]-1-azabicyclo[2.2.2]octan-3-one

Systemtic Name: 2-[3-(4-chloranyl-3-nitro-phenyl)-3-oxidanylidene-propyl]-1-azabicyclo[2.2.2]octan-3-one Openeye Name: 2-[3-(4-chloro-3-nitro-phenyl)-3-oxo-propyl]quinuclidin-3-one CAS Name: 2-[3-(4-chloro-3-nitrophenyl)-3-oxopropyl]-1-azabicyclo[2.2.2]octan-3-one IUPAC Name: 2-[3-(4-chloro-3-nitrophenyl)-3-oxopropyl]-1-azabicyclo[2.2.2]octan-3-one Traditional Name: 2-[3-(4-chloro-3-nitro-phenyl)-3-keto-propyl]quinuclidin-3-one Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(=O)C2CCC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN2CCC1C(=O)C2CCC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN2O4/c17-12-2-1-11(9-14(12)19(22)23)15(20)4-3-13-16(21)10-5-7-18(13)8-6-10/h1-2,9-10,13H,3-8H2