(Z,5S)-5-[2,2-bis(chloranyl)ethanoylamino]-1-diazonio-6-methoxy-6-oxidanylidene-hex-1-en-2-olate

Systemtic Name: (Z,5S)-5-[2,2-bis(chloranyl)ethanoylamino]-1-diazonio-6-methoxy-6-oxidanylidene-hex-1-en-2-olate Openeye Name: (Z,5S)-1-diazonio-5-[(2,2-dichloroacetyl)amino]-6-methoxy-6-oxo-hex-1-en-2-olate CAS Name: (Z,5S)-1-diazonio-5-[(2,2-dichloro-1-oxoethyl)amino]-6-methoxy-6-oxo-1-hexen-2-olate IUPAC Name: (Z,5S)-1-diazonio-5-[(2,2-dichloroacetyl)amino]-6-methoxy-6-oxohex-1-en-2-olate Traditional Name: (Z,5S)-1-diazonio-5-[(2,2-dichloroacetyl)amino]-6-keto-6-methoxy-hex-1-en-2-olate Formula: C9H11Cl2N3O4 MolecularWeight: 296.10734

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(=C[N+]#N)[O-])NC(=O)C(Cl)Cl

Isomeric SMILES

COC(=O)[C@H](CC/C(=C/[N+]#N)/[O-])NC(=O)C(Cl)Cl

InChI

InChI=1S/C9H11Cl2N3O4/c1-18-9(17)6(14-8(16)7(10)11)3-2-5(15)4-13-12/h4,6-7H,2-3H2,1H3,(H-,14,15,16)/b5-4-/t6-/m0/s1