[(3R)-5-[2,2-bis(4-chloranylphenoxy)ethanoyloxy]-3-cyano-4-oxidanylidene-pent-1-en-2-yl]azanium

Systemtic Name: [(3R)-5-[2,2-bis(4-chloranylphenoxy)ethanoyloxy]-3-cyano-4-oxidanylidene-pent-1-en-2-yl]azanium Openeye Name: [(2R)-4-[2,2-bis(4-chlorophenoxy)acetyl]oxy-2-cyano-1-methylene-3-oxo-butyl]ammonium CAS Name: [(3R)-5-[2,2-bis(4-chlorophenoxy)-1-oxoethoxy]-3-cyano-4-oxopent-1-en-2-yl]ammonium IUPAC Name: [(3R)-5-[2,2-bis(4-chlorophenoxy)acetyl]oxy-3-cyano-4-oxopent-1-en-2-yl]azanium Traditional Name: 1-[(1R)-3-[2,2-bis(4-chlorophenoxy)acetyl]oxy-1-cyano-2-keto-propyl]vinylammonium Formula: C20H17Cl2N2O5+ MolecularWeight: 436.26538

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C(C#N)C(=O)COC(=O)C(OC1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)Cl)[NH3+]

Isomeric SMILES

C=C([C@H](C#N)C(=O)COC(=O)C(OC1=CC=C(C=C1)Cl)OC2=CC=C(C=C2)Cl)[NH3+]

InChI

InChI=1S/C20H16Cl2N2O5/c1-12(24)17(10-23)18(25)11-27-19(26)20(28-15-6-2-13(21)3-7-15)29-16-8-4-14(22)5-9-16/h2-9,17,20H,1,11,24H2/p+1/t17-/m0/s1