(E)-2-diazonio-1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-2-phenyl-ethenolate

Systemtic Name: (E)-2-diazonio-1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-2-phenyl-ethenolate Openeye Name: (E)-2-diazonio-1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-2-phenyl-ethenolate CAS Name: (E)-2-diazonio-1-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-2-phenylethenolate IUPAC Name: (E)-2-diazonio-1-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-2-phenylethenolate Traditional Name: (E)-2-diazonio-1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-2-phenyl-ethenolate Formula: C18H24N2O2 MolecularWeight: 300.39536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)OC(=C(C2=CC=CC=C2)[N+]#N)[O-])C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)O/C(=C(\C2=CC=CC=C2)/[N+]#N)/[O-])C(C)C

InChI

InChI=1S/C18H24N2O2/c1-12(2)15-10-9-13(3)11-16(15)22-18(21)17(20-19)14-7-5-4-6-8-14/h4-8,12-13,15-16H,9-11H2,1-3H3/b18-17+/t13-,15+,16-/m1/s1