(Z)-2-diazonio-1-ethoxy-3-[3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]-2-oxidanylidene-piperidin-1-yl]-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-1-ethoxy-3-[3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]-2-oxidanylidene-piperidin-1-yl]-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (Z)-2-diazonio-1-ethoxy-3-[3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]-2-oxo-1-piperidyl]-3-oxo-prop-1-en-1-olate CAS Name: (Z)-2-diazonio-1-ethoxy-3-[3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]-2-oxo-1-piperidinyl]-3-oxo-1-propen-1-olate IUPAC Name: (Z)-2-diazonio-1-ethoxy-3-[3-ethyl-3-[4-(2-nitrophenyl)but-3-ynyl]-2-oxopiperidin-1-yl]-3-oxoprop-1-en-1-olate Traditional Name: (Z)-2-diazonio-1-ethoxy-3-[3-ethyl-2-keto-3-[4-(2-nitrophenyl)but-3-ynyl]piperidino]-3-keto-prop-1-en-1-olate Formula: C22H24N4O6 MolecularWeight: 440.44916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCN(C1=O)C(=O)C(=C([O-])OCC)[N+]#N)CCC#CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC1(CCCN(C1=O)C(=O)/C(=C(\[O-])/OCC)/[N+]#N)CCC#CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O6/c1-3-22(13-8-7-11-16-10-5-6-12-17(16)26(30)31)14-9-15-25(21(22)29)19(27)18(24-23)20(28)32-4-2/h5-6,10,12H,3-4,8-9,13-15H2,1-2H3