(Z)-2-diazonio-1-[(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexyl]oxy-3-oxidanylidene-but-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-1-[(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexyl]oxy-3-oxidanylidene-but-1-en-1-olate Openeye Name: (Z)-2-diazonio-1-[(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexoxy]-3-oxo-but-1-en-1-olate CAS Name: (Z)-2-diazonio-1-[(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexyl]oxy-3-oxo-1-buten-1-olate IUPAC Name: (Z)-2-diazonio-1-[(1R,2R)-2-[(4-methoxyphenyl)methoxy]cyclohexyl]oxy-3-oxobut-1-en-1-olate Traditional Name: (Z)-2-diazonio-3-keto-1-[(1R,2R)-2-p-anisyloxycyclohexoxy]but-1-en-1-olate Formula: C18H22N2O5 MolecularWeight: 346.37768

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C([O-])OC1CCCCC1OCC2=CC=C(C=C2)OC)[N+]#N

Isomeric SMILES

CC(=O)/C(=C(\[O-])/O[C@@H]1CCCC[C@H]1OCC2=CC=C(C=C2)OC)/[N+]#N

InChI

InChI=1S/C18H22N2O5/c1-12(21)17(20-19)18(22)25-16-6-4-3-5-15(16)24-11-13-7-9-14(23-2)10-8-13/h7-10,15-16H,3-6,11H2,1-2H3/t15-,16-/m1/s1