(Z)-2-diazonio-4-ethoxy-1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-3-oxidanylidene-but-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-4-ethoxy-1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]oxy-3-oxidanylidene-but-1-en-1-olate Openeye Name: (Z)-2-diazonio-4-ethoxy-1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-3-oxo-but-1-en-1-olate CAS Name: (Z)-2-diazonio-4-ethoxy-1-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-3-oxo-1-buten-1-olate IUPAC Name: (Z)-2-diazonio-4-ethoxy-1-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxy-3-oxobut-1-en-1-olate Traditional Name: (Z)-2-diazonio-4-ethoxy-1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexoxy]-3-keto-but-1-en-1-olate Formula: C16H26N2O4 MolecularWeight: 310.38864

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)C(=C([O-])OC1CC(CCC1C(C)C)C)[N+]#N

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2O4/c1-5-21-9-13(19)15(18-17)16(20)22-14-8-11(4)6-7-12(14)10(2)3/h10-12,14H,5-9H2,1-4H3/t11-,12+,14-/m1/s1