(1Z)-2-diazonio-1-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-3-oxidanylidene-hepta-1,6-dien-1-olate

Systemtic Name: (1Z)-2-diazonio-1-[(1S,2R,5S)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-3-oxidanylidene-hepta-1,6-dien-1-olate Openeye Name: (1Z)-2-diazonio-1-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexoxy]-3-oxo-hepta-1,6-dien-1-olate CAS Name: (1Z)-2-diazonio-1-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxy-3-oxo-1-hepta-1,6-dienolate IUPAC Name: (1Z)-2-diazonio-1-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxy-3-oxohepta-1,6-dien-1-olate Traditional Name: (1Z)-2-diazonio-1-[(1S,2R,5S)-2-isopropyl-5-methyl-cyclohexoxy]-3-keto-hepta-1,6-dien-1-olate Formula: C17H26N2O3 MolecularWeight: 306.39994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N2O3/c1-5-6-7-14(20)16(19-18)17(21)22-15-10-12(4)8-9-13(15)11(2)3/h5,11-13,15H,1,6-10H2,2-4H3/t12-,13+,15-/m0/s1