methyl 2-[3-(4-chloranyl-2-nitro-phenoxy)quinoxalin-2-yl]-2-cyano-ethanoate

Systemtic Name: methyl 2-[3-(4-chloranyl-2-nitro-phenoxy)quinoxalin-2-yl]-2-cyano-ethanoate Openeye Name: methyl 2-[3-(4-chloro-2-nitro-phenoxy)quinoxalin-2-yl]-2-cyano-acetate CAS Name: 2-[3-(4-chloro-2-nitrophenoxy)-2-quinoxalinyl]-2-cyanoacetic acid methyl ester IUPAC Name: methyl 2-[3-(4-chloro-2-nitrophenoxy)quinoxalin-2-yl]-2-cyanoacetate Traditional Name: 2-[3-(4-chloro-2-nitro-phenoxy)quinoxalin-2-yl]-2-cyano-acetic acid methyl ester Formula: C18H11ClN4O5 MolecularWeight: 398.75674

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1OC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H11ClN4O5/c1-27-18(24)11(9-20)16-17(22-13-5-3-2-4-12(13)21-16)28-15-7-6-10(19)8-14(15)23(25)26/h2-8,11H,1H3