4-[2-(4-chlorophenyl)sulfonyl-2-cyano-ethenyl]-2-ethoxy-6-nitro-phenolate

Systemtic Name: 4-[2-(4-chlorophenyl)sulfonyl-2-cyano-ethenyl]-2-ethoxy-6-nitro-phenolate Openeye Name: 4-[2-(4-chlorophenyl)sulfonyl-2-cyano-vinyl]-2-ethoxy-6-nitro-phenolate CAS Name: 4-[2-(4-chlorophenyl)sulfonyl-2-cyanoethenyl]-2-ethoxy-6-nitrophenolate IUPAC Name: 4-[2-(4-chlorophenyl)sulfonyl-2-cyanoethenyl]-2-ethoxy-6-nitrophenolate Traditional Name: 4-[2-(4-chlorophenyl)sulfonyl-2-cyano-vinyl]-2-ethoxy-6-nitro-phenolate Formula: C17H12ClN2O6S- MolecularWeight: 407.80498

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1[O-])[N+](=O)[O-])C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H13ClN2O6S/c1-2-26-16-9-11(8-15(17(16)21)20(22)23)7-14(10-19)27(24,25)13-5-3-12(18)4-6-13/h3-9,21H,2H2,1H3/p-1