2-chloranyl-4-methoxy-5-nitro-3-oxidanyl-benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-methoxy-5-nitro-3-oxidanyl-benzenecarbonitrile Openeye Name: 2-chloro-3-hydroxy-4-methoxy-5-nitro-benzonitrile CAS Name: 2-chloro-3-hydroxy-4-methoxy-5-nitrobenzonitrile IUPAC Name: 2-chloro-3-hydroxy-4-methoxy-5-nitrobenzonitrile Traditional Name: 2-chloro-3-hydroxy-4-methoxy-5-nitro-benzonitrile Formula: C8H5ClN2O4 MolecularWeight: 228.5893

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1O)Cl)C#N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C(=C1O)Cl)C#N)[N+](=O)[O-]

InChI

InChI=1S/C8H5ClN2O4/c1-15-8-5(11(13)14)2-4(3-10)6(9)7(8)12/h2,12H,1H3